USER MOD reduce.3.24.130724 H: found=0, std=0, add=861, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 860 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 138 GLN : amide:sc= -0.469 X(o=-1.2,f=-0.72) USER MOD Set 1.2: B 142 GLN : amide:sc= -0.7 X(o=-1.2,f=-0.72) USER MOD Single : A 1 GLY N :NH3+ 139:sc= 0.00855 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0.071 USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0666) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= -0.144 USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 LYS NZ :NH3+ 172:sc=-0.000697 (180deg=-0.0851) USER MOD Single : A 25 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 26 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 28 GLN : amide:sc= -0.0482 X(o=-0.048,f=-0.015) USER MOD Single : A 35 GLN : amide:sc= -0.152 X(o=-0.15,f=-0.15) USER MOD Single : A 36 LYS NZ :NH3+ 156:sc= 1.29 (180deg=1.11) USER MOD Single : A 37 TYR OH : rot 30:sc= -0.079 USER MOD Single : A 38 GLN : amide:sc= -1.91 K(o=-1.9,f=-0.056) USER MOD Single : A 39 SER OG : rot 80:sc= 0.266 USER MOD Single : A 40 LYS NZ :NH3+ 153:sc= 0.779 (180deg=0.362) USER MOD Single : A 42 GLN : amide:sc= -1.09 K(o=-1.1,f=-0.18) USER MOD Single : A 51 LYS NZ :NH3+ -149:sc= 1.22 (180deg=0.427) USER MOD Single : B 102 SER OG : rot 180:sc= 0.0595 USER MOD Single : B 104 TYR OH : rot 180:sc= 0 USER MOD Single : B 108 LYS NZ :NH3+ 178:sc= 1.5 (180deg=1.43) USER MOD Single : B 109 SER OG : rot 180:sc= 0 USER MOD Single : B 111 THR OG1 : rot 180:sc= -0.169 USER MOD Single : B 116 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 125 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 126 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 128 GLN : amide:sc= -0.569 X(o=-0.57,f=-0.16) USER MOD Single : B 135 GLN : amide:sc= -0.113 X(o=-0.11,f=-0.11) USER MOD Single : B 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 137 TYR OH : rot 165:sc= 0 USER MOD Single : B 139 SER OG : rot 85:sc= 0.349 USER MOD Single : B 140 LYS NZ :NH3+ -152:sc= 1.15 (180deg=0.325) USER MOD Single : B 151 LYS NZ :NH3+ -147:sc= 1.22 (180deg=0.543) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -16.203 -4.712 15.356 1.00 0.00 N ATOM 2 CA GLY A 1 -15.674 -4.006 14.180 1.00 0.00 C ATOM 3 C GLY A 1 -16.807 -3.674 13.223 1.00 0.00 C ATOM 4 O GLY A 1 -17.630 -4.539 12.936 1.00 0.00 O ATOM 0 H1 GLY A 1 -15.558 -5.485 15.616 1.00 0.00 H new ATOM 0 H2 GLY A 1 -16.286 -4.047 16.152 1.00 0.00 H new ATOM 0 H3 GLY A 1 -17.140 -5.104 15.133 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -15.169 -3.091 14.491 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -14.931 -4.625 13.677 1.00 0.00 H new ATOM 8 N SER A 2 -16.842 -2.432 12.733 1.00 0.00 N ATOM 9 CA SER A 2 -17.829 -1.862 11.818 1.00 0.00 C ATOM 10 C SER A 2 -18.242 -2.804 10.676 1.00 0.00 C ATOM 11 O SER A 2 -17.554 -2.895 9.660 1.00 0.00 O ATOM 12 CB SER A 2 -17.272 -0.536 11.281 1.00 0.00 C ATOM 13 OG SER A 2 -16.750 0.245 12.345 1.00 0.00 O ATOM 0 H SER A 2 -16.127 -1.750 12.986 1.00 0.00 H new ATOM 0 HA SER A 2 -18.750 -1.695 12.377 1.00 0.00 H new ATOM 0 HB2 SER A 2 -16.490 -0.732 10.547 1.00 0.00 H new ATOM 0 HB3 SER A 2 -18.059 0.016 10.768 1.00 0.00 H new ATOM 0 HG SER A 2 -16.396 1.087 11.990 1.00 0.00 H new ATOM 19 N ASP A 3 -19.392 -3.463 10.827 1.00 0.00 N ATOM 20 CA ASP A 3 -19.939 -4.401 9.848 1.00 0.00 C ATOM 21 C ASP A 3 -20.331 -3.654 8.582 1.00 0.00 C ATOM 22 O ASP A 3 -20.887 -2.554 8.671 1.00 0.00 O ATOM 23 CB ASP A 3 -21.183 -5.102 10.414 1.00 0.00 C ATOM 24 CG ASP A 3 -20.801 -6.111 11.483 1.00 0.00 C ATOM 25 OD1 ASP A 3 -20.429 -7.250 11.141 1.00 0.00 O ATOM 26 OD2 ASP A 3 -20.743 -5.754 12.682 1.00 0.00 O ATOM 0 H ASP A 3 -19.982 -3.356 11.652 1.00 0.00 H new ATOM 0 HA ASP A 3 -19.176 -5.145 9.621 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -21.862 -4.361 10.835 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -21.719 -5.605 9.609 1.00 0.00 H new ATOM 31 N TYR A 4 -20.082 -4.235 7.408 1.00 0.00 N ATOM 32 CA TYR A 4 -20.423 -3.628 6.123 1.00 0.00 C ATOM 33 C TYR A 4 -21.535 -4.404 5.413 1.00 0.00 C ATOM 34 O TYR A 4 -22.304 -3.787 4.693 1.00 0.00 O ATOM 35 CB TYR A 4 -19.184 -3.524 5.213 1.00 0.00 C ATOM 36 CG TYR A 4 -18.199 -2.419 5.566 1.00 0.00 C ATOM 37 CD1 TYR A 4 -17.167 -2.672 6.491 1.00 0.00 C ATOM 38 CD2 TYR A 4 -18.284 -1.147 4.955 1.00 0.00 C ATOM 39 CE1 TYR A 4 -16.239 -1.669 6.824 1.00 0.00 C ATOM 40 CE2 TYR A 4 -17.338 -0.151 5.259 1.00 0.00 C ATOM 41 CZ TYR A 4 -16.320 -0.403 6.203 1.00 0.00 C ATOM 42 OH TYR A 4 -15.440 0.591 6.509 1.00 0.00 O ATOM 0 H TYR A 4 -19.634 -5.148 7.323 1.00 0.00 H new ATOM 0 HA TYR A 4 -20.789 -2.622 6.329 1.00 0.00 H new ATOM 0 HB2 TYR A 4 -18.657 -4.478 5.237 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -19.521 -3.372 4.187 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -17.088 -3.647 6.949 1.00 0.00 H new ATOM 0 HD2 TYR A 4 -19.078 -0.939 4.253 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -15.467 -1.866 7.553 1.00 0.00 H new ATOM 0 HE2 TYR A 4 -17.391 0.810 4.768 1.00 0.00 H new ATOM 0 HH TYR A 4 -15.651 1.389 5.981 1.00 0.00 H new ATOM 52 N GLU A 5 -21.724 -5.703 5.658 1.00 0.00 N ATOM 53 CA GLU A 5 -22.755 -6.499 4.970 1.00 0.00 C ATOM 54 C GLU A 5 -24.194 -5.965 5.111 1.00 0.00 C ATOM 55 O GLU A 5 -25.028 -6.248 4.252 1.00 0.00 O ATOM 56 CB GLU A 5 -22.640 -7.987 5.351 1.00 0.00 C ATOM 57 CG GLU A 5 -21.215 -8.514 5.100 1.00 0.00 C ATOM 58 CD GLU A 5 -21.143 -10.032 4.953 1.00 0.00 C ATOM 59 OE1 GLU A 5 -21.363 -10.534 3.822 1.00 0.00 O ATOM 60 OE2 GLU A 5 -20.770 -10.702 5.950 1.00 0.00 O ATOM 0 H GLU A 5 -21.173 -6.234 6.333 1.00 0.00 H new ATOM 0 HA GLU A 5 -22.545 -6.394 3.906 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -22.900 -8.118 6.401 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -23.355 -8.571 4.771 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -20.819 -8.050 4.197 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -20.572 -8.206 5.925 1.00 0.00 H new ATOM 67 N PHE A 6 -24.501 -5.178 6.148 1.00 0.00 N ATOM 68 CA PHE A 6 -25.825 -4.592 6.388 1.00 0.00 C ATOM 69 C PHE A 6 -26.075 -3.310 5.585 1.00 0.00 C ATOM 70 O PHE A 6 -27.177 -2.762 5.635 1.00 0.00 O ATOM 71 CB PHE A 6 -25.997 -4.306 7.885 1.00 0.00 C ATOM 72 CG PHE A 6 -26.416 -5.537 8.650 1.00 0.00 C ATOM 73 CD1 PHE A 6 -25.449 -6.471 9.050 1.00 0.00 C ATOM 74 CD2 PHE A 6 -27.781 -5.787 8.883 1.00 0.00 C ATOM 75 CE1 PHE A 6 -25.847 -7.652 9.697 1.00 0.00 C ATOM 76 CE2 PHE A 6 -28.178 -6.967 9.535 1.00 0.00 C ATOM 77 CZ PHE A 6 -27.209 -7.900 9.942 1.00 0.00 C ATOM 0 H PHE A 6 -23.818 -4.924 6.862 1.00 0.00 H new ATOM 0 HA PHE A 6 -26.560 -5.323 6.050 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -25.059 -3.928 8.292 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -26.743 -3.523 8.021 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -24.402 -6.283 8.861 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -28.524 -5.072 8.561 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -25.104 -8.372 10.007 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -29.225 -7.156 9.723 1.00 0.00 H new ATOM 0 HZ PHE A 6 -27.511 -8.808 10.443 1.00 0.00 H new ATOM 87 N LEU A 7 -25.080 -2.819 4.841 1.00 0.00 N ATOM 88 CA LEU A 7 -25.222 -1.595 4.047 1.00 0.00 C ATOM 89 C LEU A 7 -26.223 -1.739 2.902 1.00 0.00 C ATOM 90 O LEU A 7 -26.614 -0.748 2.299 1.00 0.00 O ATOM 91 CB LEU A 7 -23.854 -1.063 3.591 1.00 0.00 C ATOM 92 CG LEU A 7 -23.114 -1.847 2.489 1.00 0.00 C ATOM 93 CD1 LEU A 7 -23.527 -1.448 1.077 1.00 0.00 C ATOM 94 CD2 LEU A 7 -21.612 -1.549 2.591 1.00 0.00 C ATOM 0 H LEU A 7 -24.160 -3.254 4.772 1.00 0.00 H new ATOM 0 HA LEU A 7 -25.653 -0.838 4.702 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -23.991 -0.040 3.241 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -23.204 -1.016 4.464 1.00 0.00 H new ATOM 0 HG LEU A 7 -23.362 -2.897 2.647 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -22.967 -2.040 0.353 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -24.594 -1.629 0.945 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -23.316 -0.390 0.922 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -21.079 -2.099 1.816 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -21.443 -0.480 2.459 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -21.246 -1.856 3.571 1.00 0.00 H new ATOM 106 N LYS A 8 -26.668 -2.957 2.600 1.00 0.00 N ATOM 107 CA LYS A 8 -27.639 -3.245 1.541 1.00 0.00 C ATOM 108 C LYS A 8 -28.959 -2.478 1.710 1.00 0.00 C ATOM 109 O LYS A 8 -29.691 -2.315 0.736 1.00 0.00 O ATOM 110 CB LYS A 8 -28.014 -4.733 1.608 1.00 0.00 C ATOM 111 CG LYS A 8 -26.891 -5.746 1.388 1.00 0.00 C ATOM 112 CD LYS A 8 -26.425 -5.912 -0.057 1.00 0.00 C ATOM 113 CE LYS A 8 -25.815 -7.311 -0.232 1.00 0.00 C ATOM 114 NZ LYS A 8 -24.743 -7.635 0.735 1.00 0.00 N ATOM 0 H LYS A 8 -26.357 -3.793 3.096 1.00 0.00 H new ATOM 0 HA LYS A 8 -27.167 -2.953 0.603 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -28.457 -4.926 2.585 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -28.789 -4.920 0.864 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -26.035 -5.450 1.995 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -27.224 -6.716 1.757 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -27.264 -5.780 -0.740 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -25.689 -5.147 -0.305 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -26.607 -8.054 -0.140 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -25.414 -7.396 -1.242 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -24.249 -8.498 0.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -24.066 -6.847 0.780 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -25.159 -7.788 1.676 1.00 0.00 H new ATOM 128 N SER A 9 -29.283 -2.044 2.928 1.00 0.00 N ATOM 129 CA SER A 9 -30.516 -1.341 3.258 1.00 0.00 C ATOM 130 C SER A 9 -30.406 0.174 3.104 1.00 0.00 C ATOM 131 O SER A 9 -31.403 0.882 3.234 1.00 0.00 O ATOM 132 CB SER A 9 -30.849 -1.648 4.726 1.00 0.00 C ATOM 133 OG SER A 9 -30.649 -3.015 5.051 1.00 0.00 O ATOM 0 H SER A 9 -28.674 -2.178 3.735 1.00 0.00 H new ATOM 0 HA SER A 9 -31.287 -1.682 2.567 1.00 0.00 H new ATOM 0 HB2 SER A 9 -30.229 -1.029 5.374 1.00 0.00 H new ATOM 0 HB3 SER A 9 -31.886 -1.378 4.925 1.00 0.00 H new ATOM 0 HG SER A 9 -30.871 -3.163 5.994 1.00 0.00 H new ATOM 139 N TRP A 10 -29.197 0.682 2.889 1.00 0.00 N ATOM 140 CA TRP A 10 -28.932 2.097 2.757 1.00 0.00 C ATOM 141 C TRP A 10 -29.389 2.677 1.429 1.00 0.00 C ATOM 142 O TRP A 10 -29.715 1.974 0.464 1.00 0.00 O ATOM 143 CB TRP A 10 -27.421 2.281 2.856 1.00 0.00 C ATOM 144 CG TRP A 10 -26.745 1.975 4.153 1.00 0.00 C ATOM 145 CD1 TRP A 10 -25.409 2.058 4.295 1.00 0.00 C ATOM 146 CD2 TRP A 10 -27.269 1.591 5.468 1.00 0.00 C ATOM 147 NE1 TRP A 10 -25.056 1.725 5.580 1.00 0.00 N ATOM 148 CE2 TRP A 10 -26.161 1.478 6.361 1.00 0.00 C ATOM 149 CE3 TRP A 10 -28.548 1.364 6.028 1.00 0.00 C ATOM 150 CZ2 TRP A 10 -26.314 1.183 7.721 1.00 0.00 C ATOM 151 CZ3 TRP A 10 -28.714 1.054 7.389 1.00 0.00 C ATOM 152 CH2 TRP A 10 -27.600 0.973 8.239 1.00 0.00 C ATOM 0 H TRP A 10 -28.362 0.104 2.801 1.00 0.00 H new ATOM 0 HA TRP A 10 -29.484 2.617 3.540 1.00 0.00 H new ATOM 0 HB2 TRP A 10 -26.961 1.658 2.088 1.00 0.00 H new ATOM 0 HB3 TRP A 10 -27.197 3.317 2.603 1.00 0.00 H new ATOM 0 HD1 TRP A 10 -24.718 2.344 3.515 1.00 0.00 H new ATOM 0 HE1 TRP A 10 -24.094 1.668 5.914 1.00 0.00 H new ATOM 0 HE3 TRP A 10 -29.419 1.431 5.394 1.00 0.00 H new ATOM 0 HZ2 TRP A 10 -25.450 1.118 8.365 1.00 0.00 H new ATOM 0 HZ3 TRP A 10 -29.704 0.877 7.783 1.00 0.00 H new ATOM 0 HH2 TRP A 10 -27.733 0.750 9.287 1.00 0.00 H new ATOM 163 N THR A 11 -29.424 4.004 1.408 1.00 0.00 N ATOM 164 CA THR A 11 -29.776 4.754 0.224 1.00 0.00 C ATOM 165 C THR A 11 -28.566 4.679 -0.706 1.00 0.00 C ATOM 166 O THR A 11 -27.435 4.426 -0.269 1.00 0.00 O ATOM 167 CB THR A 11 -30.074 6.225 0.570 1.00 0.00 C ATOM 168 OG1 THR A 11 -29.092 6.781 1.420 1.00 0.00 O ATOM 169 CG2 THR A 11 -31.443 6.395 1.221 1.00 0.00 C ATOM 0 H THR A 11 -29.207 4.585 2.218 1.00 0.00 H new ATOM 0 HA THR A 11 -30.672 4.342 -0.239 1.00 0.00 H new ATOM 0 HB THR A 11 -30.063 6.757 -0.381 1.00 0.00 H new ATOM 0 HG1 THR A 11 -29.318 7.715 1.614 1.00 0.00 H new ATOM 0 HG21 THR A 11 -31.610 7.448 1.447 1.00 0.00 H new ATOM 0 HG22 THR A 11 -32.217 6.044 0.538 1.00 0.00 H new ATOM 0 HG23 THR A 11 -31.482 5.815 2.143 1.00 0.00 H new ATOM 177 N VAL A 12 -28.797 4.909 -1.997 1.00 0.00 N ATOM 178 CA VAL A 12 -27.721 4.906 -2.963 1.00 0.00 C ATOM 179 C VAL A 12 -26.651 5.937 -2.578 1.00 0.00 C ATOM 180 O VAL A 12 -25.468 5.667 -2.765 1.00 0.00 O ATOM 181 CB VAL A 12 -28.324 5.118 -4.367 1.00 0.00 C ATOM 182 CG1 VAL A 12 -29.010 6.480 -4.563 1.00 0.00 C ATOM 183 CG2 VAL A 12 -27.274 4.896 -5.445 1.00 0.00 C ATOM 0 H VAL A 12 -29.719 5.098 -2.389 1.00 0.00 H new ATOM 0 HA VAL A 12 -27.203 3.947 -2.973 1.00 0.00 H new ATOM 0 HB VAL A 12 -29.112 4.370 -4.459 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -29.406 6.546 -5.577 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -29.826 6.583 -3.848 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -28.285 7.279 -4.404 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -27.722 5.051 -6.427 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -26.454 5.601 -5.305 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -26.892 3.877 -5.377 1.00 0.00 H new ATOM 193 N GLU A 13 -27.031 7.074 -1.985 1.00 0.00 N ATOM 194 CA GLU A 13 -26.050 8.074 -1.597 1.00 0.00 C ATOM 195 C GLU A 13 -25.191 7.560 -0.449 1.00 0.00 C ATOM 196 O GLU A 13 -23.967 7.547 -0.558 1.00 0.00 O ATOM 197 CB GLU A 13 -26.741 9.359 -1.144 1.00 0.00 C ATOM 198 CG GLU A 13 -27.371 10.147 -2.292 1.00 0.00 C ATOM 199 CD GLU A 13 -28.053 11.378 -1.713 1.00 0.00 C ATOM 200 OE1 GLU A 13 -29.126 11.212 -1.094 1.00 0.00 O ATOM 201 OE2 GLU A 13 -27.469 12.486 -1.805 1.00 0.00 O ATOM 0 H GLU A 13 -27.998 7.316 -1.769 1.00 0.00 H new ATOM 0 HA GLU A 13 -25.425 8.279 -2.466 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -27.514 9.110 -0.417 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -26.015 9.992 -0.634 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -26.609 10.440 -3.014 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -28.093 9.529 -2.825 1.00 0.00 H new ATOM 208 N ASP A 14 -25.819 7.110 0.639 1.00 0.00 N ATOM 209 CA ASP A 14 -25.111 6.625 1.824 1.00 0.00 C ATOM 210 C ASP A 14 -24.137 5.507 1.521 1.00 0.00 C ATOM 211 O ASP A 14 -23.103 5.396 2.185 1.00 0.00 O ATOM 212 CB ASP A 14 -26.078 6.198 2.932 1.00 0.00 C ATOM 213 CG ASP A 14 -26.215 7.305 3.985 1.00 0.00 C ATOM 214 OD1 ASP A 14 -26.416 8.480 3.612 1.00 0.00 O ATOM 215 OD2 ASP A 14 -26.012 7.029 5.194 1.00 0.00 O ATOM 0 H ASP A 14 -26.835 7.072 0.723 1.00 0.00 H new ATOM 0 HA ASP A 14 -24.527 7.474 2.179 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -27.055 5.974 2.503 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -25.719 5.283 3.403 1.00 0.00 H new ATOM 220 N LEU A 15 -24.475 4.623 0.584 1.00 0.00 N ATOM 221 CA LEU A 15 -23.571 3.546 0.229 1.00 0.00 C ATOM 222 C LEU A 15 -22.478 4.104 -0.697 1.00 0.00 C ATOM 223 O LEU A 15 -21.301 3.808 -0.483 1.00 0.00 O ATOM 224 CB LEU A 15 -24.346 2.327 -0.310 1.00 0.00 C ATOM 225 CG LEU A 15 -24.702 2.382 -1.801 1.00 0.00 C ATOM 226 CD1 LEU A 15 -23.505 1.970 -2.666 1.00 0.00 C ATOM 227 CD2 LEU A 15 -25.909 1.499 -2.120 1.00 0.00 C ATOM 0 H LEU A 15 -25.355 4.635 0.068 1.00 0.00 H new ATOM 0 HA LEU A 15 -23.056 3.155 1.107 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -23.753 1.431 -0.128 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -25.267 2.221 0.263 1.00 0.00 H new ATOM 0 HG LEU A 15 -24.964 3.414 -2.034 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -23.783 2.017 -3.719 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -22.672 2.647 -2.480 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -23.208 0.952 -2.415 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -26.134 1.561 -3.185 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -25.684 0.466 -1.857 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -26.771 1.840 -1.546 1.00 0.00 H new ATOM 239 N GLN A 16 -22.827 4.925 -1.700 1.00 0.00 N ATOM 240 CA GLN A 16 -21.872 5.491 -2.651 1.00 0.00 C ATOM 241 C GLN A 16 -20.833 6.331 -1.921 1.00 0.00 C ATOM 242 O GLN A 16 -19.661 6.297 -2.278 1.00 0.00 O ATOM 243 CB GLN A 16 -22.611 6.270 -3.741 1.00 0.00 C ATOM 244 CG GLN A 16 -21.685 6.769 -4.856 1.00 0.00 C ATOM 245 CD GLN A 16 -22.532 7.321 -5.995 1.00 0.00 C ATOM 246 OE1 GLN A 16 -22.985 8.462 -5.934 1.00 0.00 O ATOM 247 NE2 GLN A 16 -22.824 6.514 -6.996 1.00 0.00 N ATOM 0 H GLN A 16 -23.790 5.214 -1.871 1.00 0.00 H new ATOM 0 HA GLN A 16 -21.330 4.687 -3.149 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -23.382 5.633 -4.175 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -23.118 7.123 -3.289 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -21.018 7.542 -4.474 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -21.056 5.955 -5.215 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -22.434 5.572 -7.022 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -23.440 6.832 -7.745 1.00 0.00 H new ATOM 256 N LYS A 17 -21.225 7.030 -0.853 1.00 0.00 N ATOM 257 CA LYS A 17 -20.322 7.837 -0.042 1.00 0.00 C ATOM 258 C LYS A 17 -19.178 6.954 0.454 1.00 0.00 C ATOM 259 O LYS A 17 -18.023 7.385 0.428 1.00 0.00 O ATOM 260 CB LYS A 17 -21.098 8.453 1.135 1.00 0.00 C ATOM 261 CG LYS A 17 -21.339 9.956 0.971 1.00 0.00 C ATOM 262 CD LYS A 17 -22.238 10.358 -0.207 1.00 0.00 C ATOM 263 CE LYS A 17 -22.571 11.858 -0.159 1.00 0.00 C ATOM 264 NZ LYS A 17 -21.372 12.725 -0.086 1.00 0.00 N ATOM 0 H LYS A 17 -22.191 7.049 -0.527 1.00 0.00 H new ATOM 0 HA LYS A 17 -19.905 8.651 -0.635 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -22.057 7.946 1.236 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -20.546 8.278 2.058 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -21.783 10.337 1.891 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -20.374 10.450 0.854 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -21.739 10.123 -1.147 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -23.159 9.776 -0.181 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -23.148 12.123 -1.045 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -23.205 12.054 0.705 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -21.656 13.720 -0.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -20.905 12.595 0.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -20.712 12.470 -0.848 1.00 0.00 H new ATOM 278 N ARG A 18 -19.481 5.728 0.902 1.00 0.00 N ATOM 279 CA ARG A 18 -18.453 4.810 1.374 1.00 0.00 C ATOM 280 C ARG A 18 -17.588 4.359 0.206 1.00 0.00 C ATOM 281 O ARG A 18 -16.386 4.216 0.395 1.00 0.00 O ATOM 282 CB ARG A 18 -19.040 3.579 2.084 1.00 0.00 C ATOM 283 CG ARG A 18 -19.849 3.919 3.339 1.00 0.00 C ATOM 284 CD ARG A 18 -20.023 2.686 4.232 1.00 0.00 C ATOM 285 NE ARG A 18 -20.697 3.017 5.495 1.00 0.00 N ATOM 286 CZ ARG A 18 -20.169 3.627 6.562 1.00 0.00 C ATOM 287 NH1 ARG A 18 -18.893 4.001 6.570 1.00 0.00 N ATOM 288 NH2 ARG A 18 -20.914 3.865 7.633 1.00 0.00 N ATOM 0 H ARG A 18 -20.430 5.356 0.945 1.00 0.00 H new ATOM 0 HA ARG A 18 -17.851 5.351 2.104 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -19.679 3.039 1.386 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -18.227 2.907 2.358 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -19.346 4.708 3.897 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -20.827 4.305 3.052 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -20.600 1.930 3.699 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -19.047 2.250 4.444 1.00 0.00 H new ATOM 0 HE ARG A 18 -21.679 2.751 5.566 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -18.304 3.824 5.756 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -18.503 4.465 7.390 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -21.894 3.583 7.646 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -20.507 4.330 8.444 1.00 0.00 H new ATOM 302 N LEU A 19 -18.176 4.100 -0.967 1.00 0.00 N ATOM 303 CA LEU A 19 -17.467 3.650 -2.170 1.00 0.00 C ATOM 304 C LEU A 19 -16.436 4.697 -2.570 1.00 0.00 C ATOM 305 O LEU A 19 -15.267 4.382 -2.756 1.00 0.00 O ATOM 306 CB LEU A 19 -18.471 3.391 -3.313 1.00 0.00 C ATOM 307 CG LEU A 19 -18.000 2.361 -4.362 1.00 0.00 C ATOM 308 CD1 LEU A 19 -19.194 1.917 -5.216 1.00 0.00 C ATOM 309 CD2 LEU A 19 -16.910 2.899 -5.295 1.00 0.00 C ATOM 0 H LEU A 19 -19.181 4.200 -1.110 1.00 0.00 H new ATOM 0 HA LEU A 19 -16.949 2.714 -1.962 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -19.411 3.047 -2.882 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -18.678 4.335 -3.817 1.00 0.00 H new ATOM 0 HG LEU A 19 -17.574 1.526 -3.805 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -18.861 1.190 -5.957 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -19.950 1.463 -4.576 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -19.620 2.782 -5.723 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -16.625 2.124 -6.007 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -17.289 3.767 -5.835 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -16.039 3.190 -4.708 1.00 0.00 H new ATOM 321 N LEU A 20 -16.874 5.949 -2.653 1.00 0.00 N ATOM 322 CA LEU A 20 -16.054 7.082 -3.008 1.00 0.00 C ATOM 323 C LEU A 20 -14.931 7.221 -1.987 1.00 0.00 C ATOM 324 O LEU A 20 -13.778 7.285 -2.383 1.00 0.00 O ATOM 325 CB LEU A 20 -16.949 8.324 -3.086 1.00 0.00 C ATOM 326 CG LEU A 20 -16.142 9.626 -3.155 1.00 0.00 C ATOM 327 CD1 LEU A 20 -15.273 9.729 -4.411 1.00 0.00 C ATOM 328 CD2 LEU A 20 -17.111 10.808 -3.104 1.00 0.00 C ATOM 0 H LEU A 20 -17.844 6.202 -2.467 1.00 0.00 H new ATOM 0 HA LEU A 20 -15.586 6.951 -3.983 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -17.590 8.251 -3.964 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -17.603 8.352 -2.215 1.00 0.00 H new ATOM 0 HG LEU A 20 -15.462 9.636 -2.303 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -14.728 10.673 -4.400 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -14.565 8.901 -4.432 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -15.907 9.687 -5.297 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -16.550 11.741 -3.152 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -17.797 10.753 -3.949 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -17.678 10.774 -2.174 1.00 0.00 H new ATOM 340 N ALA A 21 -15.239 7.238 -0.686 1.00 0.00 N ATOM 341 CA ALA A 21 -14.234 7.368 0.373 1.00 0.00 C ATOM 342 C ALA A 21 -13.234 6.202 0.377 1.00 0.00 C ATOM 343 O ALA A 21 -12.131 6.339 0.904 1.00 0.00 O ATOM 344 CB ALA A 21 -14.924 7.470 1.736 1.00 0.00 C ATOM 0 H ALA A 21 -16.195 7.162 -0.337 1.00 0.00 H new ATOM 0 HA ALA A 21 -13.668 8.278 0.175 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -14.171 7.566 2.519 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -15.575 8.344 1.750 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -15.517 6.573 1.912 1.00 0.00 H new ATOM 350 N LEU A 22 -13.602 5.065 -0.210 1.00 0.00 N ATOM 351 CA LEU A 22 -12.785 3.858 -0.317 1.00 0.00 C ATOM 352 C LEU A 22 -11.623 4.089 -1.287 1.00 0.00 C ATOM 353 O LEU A 22 -10.568 3.462 -1.171 1.00 0.00 O ATOM 354 CB LEU A 22 -13.655 2.687 -0.836 1.00 0.00 C ATOM 355 CG LEU A 22 -13.592 1.372 -0.056 1.00 0.00 C ATOM 356 CD1 LEU A 22 -12.188 0.786 -0.023 1.00 0.00 C ATOM 357 CD2 LEU A 22 -14.144 1.530 1.362 1.00 0.00 C ATOM 0 H LEU A 22 -14.519 4.955 -0.643 1.00 0.00 H new ATOM 0 HA LEU A 22 -12.387 3.615 0.668 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -14.693 3.019 -0.855 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -13.367 2.483 -1.867 1.00 0.00 H new ATOM 0 HG LEU A 22 -14.228 0.667 -0.592 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -12.196 -0.146 0.542 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -11.851 0.590 -1.041 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -11.510 1.493 0.454 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -14.083 0.576 1.885 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -13.559 2.276 1.899 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -15.185 1.851 1.314 1.00 0.00 H new ATOM 369 N ASP A 23 -11.816 4.958 -2.277 1.00 0.00 N ATOM 370 CA ASP A 23 -10.833 5.285 -3.299 1.00 0.00 C ATOM 371 C ASP A 23 -9.635 6.060 -2.723 1.00 0.00 C ATOM 372 O ASP A 23 -8.515 5.563 -2.873 1.00 0.00 O ATOM 373 CB ASP A 23 -11.534 5.923 -4.510 1.00 0.00 C ATOM 374 CG ASP A 23 -12.328 4.913 -5.362 1.00 0.00 C ATOM 375 OD1 ASP A 23 -12.240 3.675 -5.135 1.00 0.00 O ATOM 376 OD2 ASP A 23 -13.023 5.382 -6.299 1.00 0.00 O ATOM 0 H ASP A 23 -12.691 5.469 -2.391 1.00 0.00 H new ATOM 0 HA ASP A 23 -10.370 4.374 -3.679 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -12.211 6.702 -4.159 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -10.787 6.409 -5.138 1.00 0.00 H new ATOM 381 N PRO A 24 -9.763 7.220 -2.050 1.00 0.00 N ATOM 382 CA PRO A 24 -8.605 7.913 -1.494 1.00 0.00 C ATOM 383 C PRO A 24 -8.006 7.157 -0.295 1.00 0.00 C ATOM 384 O PRO A 24 -6.867 7.438 0.069 1.00 0.00 O ATOM 385 CB PRO A 24 -9.100 9.306 -1.098 1.00 0.00 C ATOM 386 CG PRO A 24 -10.572 9.073 -0.778 1.00 0.00 C ATOM 387 CD PRO A 24 -10.964 7.979 -1.769 1.00 0.00 C ATOM 0 HA PRO A 24 -7.797 7.975 -2.223 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -8.557 9.697 -0.237 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -8.973 10.024 -1.908 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -10.716 8.754 0.254 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -11.165 9.977 -0.918 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -11.738 7.337 -1.349 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -11.370 8.413 -2.683 1.00 0.00 H new ATOM 395 N MET A 25 -8.741 6.219 0.325 1.00 0.00 N ATOM 396 CA MET A 25 -8.262 5.437 1.464 1.00 0.00 C ATOM 397 C MET A 25 -7.114 4.546 0.995 1.00 0.00 C ATOM 398 O MET A 25 -6.013 4.607 1.540 1.00 0.00 O ATOM 399 CB MET A 25 -9.396 4.569 2.039 1.00 0.00 C ATOM 400 CG MET A 25 -10.267 5.294 3.064 1.00 0.00 C ATOM 401 SD MET A 25 -9.524 5.402 4.712 1.00 0.00 S ATOM 402 CE MET A 25 -10.858 6.243 5.599 1.00 0.00 C ATOM 0 H MET A 25 -9.693 5.984 0.043 1.00 0.00 H new ATOM 0 HA MET A 25 -7.918 6.111 2.248 1.00 0.00 H new ATOM 0 HB2 MET A 25 -10.027 4.222 1.220 1.00 0.00 H new ATOM 0 HB3 MET A 25 -8.963 3.684 2.505 1.00 0.00 H new ATOM 0 HG2 MET A 25 -10.474 6.301 2.703 1.00 0.00 H new ATOM 0 HG3 MET A 25 -11.225 4.780 3.141 1.00 0.00 H new ATOM 0 HE1 MET A 25 -10.567 6.391 6.639 1.00 0.00 H new ATOM 0 HE2 MET A 25 -11.050 7.210 5.135 1.00 0.00 H new ATOM 0 HE3 MET A 25 -11.762 5.635 5.559 1.00 0.00 H new ATOM 412 N MET A 26 -7.362 3.713 -0.022 1.00 0.00 N ATOM 413 CA MET A 26 -6.322 2.834 -0.542 1.00 0.00 C ATOM 414 C MET A 26 -5.233 3.655 -1.227 1.00 0.00 C ATOM 415 O MET A 26 -4.064 3.301 -1.130 1.00 0.00 O ATOM 416 CB MET A 26 -6.897 1.760 -1.482 1.00 0.00 C ATOM 417 CG MET A 26 -7.783 2.288 -2.615 1.00 0.00 C ATOM 418 SD MET A 26 -7.412 1.727 -4.295 1.00 0.00 S ATOM 419 CE MET A 26 -5.990 2.781 -4.685 1.00 0.00 C ATOM 0 H MET A 26 -8.263 3.633 -0.493 1.00 0.00 H new ATOM 0 HA MET A 26 -5.875 2.304 0.299 1.00 0.00 H new ATOM 0 HB2 MET A 26 -6.069 1.203 -1.920 1.00 0.00 H new ATOM 0 HB3 MET A 26 -7.477 1.054 -0.888 1.00 0.00 H new ATOM 0 HG2 MET A 26 -8.814 2.017 -2.390 1.00 0.00 H new ATOM 0 HG3 MET A 26 -7.730 3.377 -2.604 1.00 0.00 H new ATOM 0 HE1 MET A 26 -5.638 2.559 -5.693 1.00 0.00 H new ATOM 0 HE2 MET A 26 -6.286 3.828 -4.626 1.00 0.00 H new ATOM 0 HE3 MET A 26 -5.189 2.590 -3.971 1.00 0.00 H new ATOM 429 N GLU A 27 -5.584 4.748 -1.909 1.00 0.00 N ATOM 430 CA GLU A 27 -4.597 5.568 -2.591 1.00 0.00 C ATOM 431 C GLU A 27 -3.560 6.117 -1.614 1.00 0.00 C ATOM 432 O GLU A 27 -2.364 6.026 -1.907 1.00 0.00 O ATOM 433 CB GLU A 27 -5.288 6.690 -3.365 1.00 0.00 C ATOM 434 CG GLU A 27 -4.285 7.392 -4.286 1.00 0.00 C ATOM 435 CD GLU A 27 -4.956 8.494 -5.087 1.00 0.00 C ATOM 436 OE1 GLU A 27 -5.534 8.202 -6.159 1.00 0.00 O ATOM 437 OE2 GLU A 27 -4.971 9.647 -4.606 1.00 0.00 O ATOM 0 H GLU A 27 -6.544 5.080 -2.000 1.00 0.00 H new ATOM 0 HA GLU A 27 -4.062 4.941 -3.304 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -6.110 6.283 -3.953 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -5.720 7.410 -2.669 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -3.474 7.813 -3.692 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -3.839 6.665 -4.965 1.00 0.00 H new ATOM 444 N GLN A 28 -4.014 6.647 -0.475 1.00 0.00 N ATOM 445 CA GLN A 28 -3.158 7.221 0.542 1.00 0.00 C ATOM 446 C GLN A 28 -2.232 6.182 1.168 1.00 0.00 C ATOM 447 O GLN A 28 -1.044 6.440 1.362 1.00 0.00 O ATOM 448 CB GLN A 28 -4.014 7.917 1.608 1.00 0.00 C ATOM 449 CG GLN A 28 -3.156 8.691 2.618 1.00 0.00 C ATOM 450 CD GLN A 28 -2.932 7.953 3.934 1.00 0.00 C ATOM 451 OE1 GLN A 28 -3.711 8.079 4.873 1.00 0.00 O ATOM 452 NE2 GLN A 28 -1.864 7.185 4.053 1.00 0.00 N ATOM 0 H GLN A 28 -5.006 6.685 -0.239 1.00 0.00 H new ATOM 0 HA GLN A 28 -2.515 7.960 0.065 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -4.710 8.602 1.124 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -4.612 7.174 2.135 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -2.188 8.909 2.166 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -3.633 9.649 2.827 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -1.219 7.083 3.269 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -1.684 6.694 4.929 1.00 0.00 H new ATOM 461 N GLU A 29 -2.761 5.019 1.523 1.00 0.00 N ATOM 462 CA GLU A 29 -1.982 3.957 2.139 1.00 0.00 C ATOM 463 C GLU A 29 -0.884 3.497 1.172 1.00 0.00 C ATOM 464 O GLU A 29 0.240 3.237 1.607 1.00 0.00 O ATOM 465 CB GLU A 29 -2.945 2.839 2.548 1.00 0.00 C ATOM 466 CG GLU A 29 -3.883 3.270 3.690 1.00 0.00 C ATOM 467 CD GLU A 29 -3.436 2.788 5.071 1.00 0.00 C ATOM 468 OE1 GLU A 29 -2.219 2.717 5.355 1.00 0.00 O ATOM 469 OE2 GLU A 29 -4.344 2.475 5.875 1.00 0.00 O ATOM 0 H GLU A 29 -3.745 4.786 1.391 1.00 0.00 H new ATOM 0 HA GLU A 29 -1.469 4.299 3.038 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -3.540 2.540 1.685 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -2.373 1.965 2.860 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -3.952 4.358 3.700 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -4.884 2.889 3.489 1.00 0.00 H new ATOM 476 N ILE A 30 -1.176 3.409 -0.135 1.00 0.00 N ATOM 477 CA ILE A 30 -0.183 3.005 -1.109 1.00 0.00 C ATOM 478 C ILE A 30 0.830 4.140 -1.224 1.00 0.00 C ATOM 479 O ILE A 30 2.019 3.847 -1.142 1.00 0.00 O ATOM 480 CB ILE A 30 -0.823 2.650 -2.490 1.00 0.00 C ATOM 481 CG1 ILE A 30 -1.282 1.172 -2.576 1.00 0.00 C ATOM 482 CG2 ILE A 30 0.174 2.861 -3.657 1.00 0.00 C ATOM 483 CD1 ILE A 30 -2.579 0.819 -1.860 1.00 0.00 C ATOM 0 H ILE A 30 -2.094 3.615 -0.529 1.00 0.00 H new ATOM 0 HA ILE A 30 0.312 2.091 -0.780 1.00 0.00 H new ATOM 0 HB ILE A 30 -1.680 3.318 -2.575 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -1.391 0.910 -3.628 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -0.488 0.544 -2.172 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -0.309 2.603 -4.599 1.00 0.00 H new ATOM 0 HG22 ILE A 30 0.488 3.905 -3.683 1.00 0.00 H new ATOM 0 HG23 ILE A 30 1.046 2.224 -3.510 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -2.792 -0.242 -1.994 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -2.479 1.037 -0.797 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -3.396 1.408 -2.276 1.00 0.00 H new ATOM 495 N GLU A 31 0.395 5.385 -1.462 1.00 0.00 N ATOM 496 CA GLU A 31 1.270 6.543 -1.644 1.00 0.00 C ATOM 497 C GLU A 31 2.253 6.706 -0.500 1.00 0.00 C ATOM 498 O GLU A 31 3.425 6.994 -0.752 1.00 0.00 O ATOM 499 CB GLU A 31 0.493 7.834 -1.980 1.00 0.00 C ATOM 500 CG GLU A 31 0.096 8.768 -0.829 1.00 0.00 C ATOM 501 CD GLU A 31 -0.627 10.028 -1.320 1.00 0.00 C ATOM 502 OE1 GLU A 31 -1.478 9.927 -2.240 1.00 0.00 O ATOM 503 OE2 GLU A 31 -0.378 11.120 -0.772 1.00 0.00 O ATOM 0 H GLU A 31 -0.596 5.616 -1.534 1.00 0.00 H new ATOM 0 HA GLU A 31 1.876 6.340 -2.527 1.00 0.00 H new ATOM 0 HB2 GLU A 31 1.095 8.410 -2.682 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -0.419 7.546 -2.503 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -0.549 8.230 -0.134 1.00 0.00 H new ATOM 0 HG3 GLU A 31 0.989 9.058 -0.275 1.00 0.00 H new ATOM 510 N GLU A 32 1.802 6.470 0.732 1.00 0.00 N ATOM 511 CA GLU A 32 2.669 6.581 1.882 1.00 0.00 C ATOM 512 C GLU A 32 3.761 5.523 1.743 1.00 0.00 C ATOM 513 O GLU A 32 4.938 5.841 1.868 1.00 0.00 O ATOM 514 CB GLU A 32 1.884 6.438 3.195 1.00 0.00 C ATOM 515 CG GLU A 32 2.778 6.916 4.345 1.00 0.00 C ATOM 516 CD GLU A 32 2.206 6.622 5.724 1.00 0.00 C ATOM 517 OE1 GLU A 32 1.367 7.412 6.216 1.00 0.00 O ATOM 518 OE2 GLU A 32 2.678 5.660 6.364 1.00 0.00 O ATOM 0 H GLU A 32 0.842 6.202 0.949 1.00 0.00 H new ATOM 0 HA GLU A 32 3.123 7.571 1.919 1.00 0.00 H new ATOM 0 HB2 GLU A 32 0.968 7.028 3.156 1.00 0.00 H new ATOM 0 HB3 GLU A 32 1.589 5.400 3.350 1.00 0.00 H new ATOM 0 HG2 GLU A 32 3.755 6.440 4.257 1.00 0.00 H new ATOM 0 HG3 GLU A 32 2.937 7.990 4.248 1.00 0.00 H new ATOM 525 N ILE A 33 3.406 4.265 1.460 1.00 0.00 N ATOM 526 CA ILE A 33 4.392 3.192 1.317 1.00 0.00 C ATOM 527 C ILE A 33 5.313 3.510 0.144 1.00 0.00 C ATOM 528 O ILE A 33 6.504 3.223 0.215 1.00 0.00 O ATOM 529 CB ILE A 33 3.739 1.803 1.134 1.00 0.00 C ATOM 530 CG1 ILE A 33 2.944 1.470 2.417 1.00 0.00 C ATOM 531 CG2 ILE A 33 4.797 0.676 0.918 1.00 0.00 C ATOM 532 CD1 ILE A 33 2.043 0.249 2.277 1.00 0.00 C ATOM 0 H ILE A 33 2.440 3.966 1.325 1.00 0.00 H new ATOM 0 HA ILE A 33 4.968 3.142 2.241 1.00 0.00 H new ATOM 0 HB ILE A 33 3.101 1.845 0.251 1.00 0.00 H new ATOM 0 HG12 ILE A 33 3.644 1.302 3.235 1.00 0.00 H new ATOM 0 HG13 ILE A 33 2.335 2.331 2.691 1.00 0.00 H new ATOM 0 HG21 ILE A 33 4.289 -0.281 0.794 1.00 0.00 H new ATOM 0 HG22 ILE A 33 5.383 0.894 0.025 1.00 0.00 H new ATOM 0 HG23 ILE A 33 5.458 0.627 1.783 1.00 0.00 H new ATOM 0 HD11 ILE A 33 1.517 0.076 3.216 1.00 0.00 H new ATOM 0 HD12 ILE A 33 1.318 0.421 1.481 1.00 0.00 H new ATOM 0 HD13 ILE A 33 2.649 -0.624 2.034 1.00 0.00 H new ATOM 544 N ARG A 34 4.799 4.098 -0.939 1.00 0.00 N ATOM 545 CA ARG A 34 5.622 4.406 -2.095 1.00 0.00 C ATOM 546 C ARG A 34 6.695 5.387 -1.710 1.00 0.00 C ATOM 547 O ARG A 34 7.859 5.117 -1.998 1.00 0.00 O ATOM 548 CB ARG A 34 4.795 4.988 -3.248 1.00 0.00 C ATOM 549 CG ARG A 34 3.874 3.916 -3.828 1.00 0.00 C ATOM 550 CD ARG A 34 3.412 4.223 -5.241 1.00 0.00 C ATOM 551 NE ARG A 34 4.560 4.178 -6.158 1.00 0.00 N ATOM 552 CZ ARG A 34 4.785 3.296 -7.133 1.00 0.00 C ATOM 553 NH1 ARG A 34 3.800 2.609 -7.697 1.00 0.00 N ATOM 554 NH2 ARG A 34 6.032 3.125 -7.534 1.00 0.00 N ATOM 0 H ARG A 34 3.820 4.367 -1.033 1.00 0.00 H new ATOM 0 HA ARG A 34 6.069 3.473 -2.437 1.00 0.00 H new ATOM 0 HB2 ARG A 34 4.204 5.832 -2.892 1.00 0.00 H new ATOM 0 HB3 ARG A 34 5.458 5.368 -4.025 1.00 0.00 H new ATOM 0 HG2 ARG A 34 4.394 2.958 -3.823 1.00 0.00 H new ATOM 0 HG3 ARG A 34 3.002 3.808 -3.183 1.00 0.00 H new ATOM 0 HD2 ARG A 34 2.657 3.501 -5.552 1.00 0.00 H new ATOM 0 HD3 ARG A 34 2.945 5.207 -5.276 1.00 0.00 H new ATOM 0 HE ARG A 34 5.265 4.904 -6.035 1.00 0.00 H new ATOM 0 HH11 ARG A 34 2.838 2.748 -7.387 1.00 0.00 H new ATOM 0 HH12 ARG A 34 4.004 1.941 -8.441 1.00 0.00 H new ATOM 0 HH21 ARG A 34 6.785 3.659 -7.100 1.00 0.00 H new ATOM 0 HH22 ARG A 34 6.242 2.459 -8.277 1.00 0.00 H new ATOM 568 N GLN A 35 6.327 6.467 -1.024 1.00 0.00 N ATOM 569 CA GLN A 35 7.333 7.449 -0.636 1.00 0.00 C ATOM 570 C GLN A 35 8.233 6.881 0.454 1.00 0.00 C ATOM 571 O GLN A 35 9.445 6.831 0.275 1.00 0.00 O ATOM 572 CB GLN A 35 6.694 8.763 -0.181 1.00 0.00 C ATOM 573 CG GLN A 35 6.141 9.545 -1.374 1.00 0.00 C ATOM 574 CD GLN A 35 7.213 10.157 -2.275 1.00 0.00 C ATOM 575 OE1 GLN A 35 7.805 11.185 -1.956 1.00 0.00 O ATOM 576 NE2 GLN A 35 7.469 9.586 -3.441 1.00 0.00 N ATOM 0 H GLN A 35 5.373 6.680 -0.734 1.00 0.00 H new ATOM 0 HA GLN A 35 7.940 7.669 -1.514 1.00 0.00 H new ATOM 0 HB2 GLN A 35 5.891 8.555 0.526 1.00 0.00 H new ATOM 0 HB3 GLN A 35 7.433 9.368 0.344 1.00 0.00 H new ATOM 0 HG2 GLN A 35 5.517 8.881 -1.971 1.00 0.00 H new ATOM 0 HG3 GLN A 35 5.496 10.342 -1.004 1.00 0.00 H new ATOM 0 HE21 GLN A 35 6.979 8.732 -3.709 1.00 0.00 H new ATOM 0 HE22 GLN A 35 8.156 10.000 -4.071 1.00 0.00 H new ATOM 585 N LYS A 36 7.659 6.362 1.539 1.00 0.00 N ATOM 586 CA LYS A 36 8.402 5.805 2.667 1.00 0.00 C ATOM 587 C LYS A 36 9.396 4.737 2.207 1.00 0.00 C ATOM 588 O LYS A 36 10.555 4.755 2.616 1.00 0.00 O ATOM 589 CB LYS A 36 7.408 5.389 3.782 1.00 0.00 C ATOM 590 CG LYS A 36 6.950 3.925 3.819 1.00 0.00 C ATOM 591 CD LYS A 36 5.569 3.686 4.455 1.00 0.00 C ATOM 592 CE LYS A 36 5.685 3.706 5.948 1.00 0.00 C ATOM 593 NZ LYS A 36 4.388 3.556 6.642 1.00 0.00 N ATOM 0 H LYS A 36 6.647 6.316 1.660 1.00 0.00 H new ATOM 0 HA LYS A 36 9.045 6.558 3.122 1.00 0.00 H new ATOM 0 HB2 LYS A 36 7.866 5.622 4.743 1.00 0.00 H new ATOM 0 HB3 LYS A 36 6.521 6.016 3.691 1.00 0.00 H new ATOM 0 HG2 LYS A 36 6.934 3.540 2.799 1.00 0.00 H new ATOM 0 HG3 LYS A 36 7.691 3.343 4.368 1.00 0.00 H new ATOM 0 HD2 LYS A 36 4.869 4.454 4.126 1.00 0.00 H new ATOM 0 HD3 LYS A 36 5.168 2.727 4.125 1.00 0.00 H new ATOM 0 HE2 LYS A 36 6.352 2.904 6.264 1.00 0.00 H new ATOM 0 HE3 LYS A 36 6.147 4.644 6.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 4.547 3.177 7.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 3.922 4.483 6.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 3.782 2.902 6.107 1.00 0.00 H new ATOM 607 N TYR A 37 8.988 3.803 1.345 1.00 0.00 N ATOM 608 CA TYR A 37 9.884 2.760 0.860 1.00 0.00 C ATOM 609 C TYR A 37 10.865 3.347 -0.147 1.00 0.00 C ATOM 610 O TYR A 37 12.023 2.946 -0.090 1.00 0.00 O ATOM 611 CB TYR A 37 9.153 1.501 0.360 1.00 0.00 C ATOM 612 CG TYR A 37 8.531 0.605 1.436 1.00 0.00 C ATOM 613 CD1 TYR A 37 8.350 1.039 2.765 1.00 0.00 C ATOM 614 CD2 TYR A 37 8.107 -0.694 1.102 1.00 0.00 C ATOM 615 CE1 TYR A 37 7.706 0.239 3.721 1.00 0.00 C ATOM 616 CE2 TYR A 37 7.480 -1.517 2.054 1.00 0.00 C ATOM 617 CZ TYR A 37 7.255 -1.043 3.360 1.00 0.00 C ATOM 618 OH TYR A 37 6.713 -1.854 4.298 1.00 0.00 O ATOM 0 H TYR A 37 8.041 3.751 0.970 1.00 0.00 H new ATOM 0 HA TYR A 37 10.462 2.393 1.708 1.00 0.00 H new ATOM 0 HB2 TYR A 37 8.364 1.813 -0.324 1.00 0.00 H new ATOM 0 HB3 TYR A 37 9.858 0.903 -0.218 1.00 0.00 H new ATOM 0 HD1 TYR A 37 8.717 2.013 3.055 1.00 0.00 H new ATOM 0 HD2 TYR A 37 8.265 -1.064 0.100 1.00 0.00 H new ATOM 0 HE1 TYR A 37 7.558 0.605 4.726 1.00 0.00 H new ATOM 0 HE2 TYR A 37 7.170 -2.515 1.782 1.00 0.00 H new ATOM 0 HH TYR A 37 6.277 -1.311 4.987 1.00 0.00 H new ATOM 628 N GLN A 38 10.473 4.306 -1.002 1.00 0.00 N ATOM 629 CA GLN A 38 11.399 4.913 -1.959 1.00 0.00 C ATOM 630 C GLN A 38 12.527 5.546 -1.160 1.00 0.00 C ATOM 631 O GLN A 38 13.693 5.305 -1.449 1.00 0.00 O ATOM 632 CB GLN A 38 10.723 5.962 -2.865 1.00 0.00 C ATOM 633 CG GLN A 38 11.715 6.586 -3.862 1.00 0.00 C ATOM 634 CD GLN A 38 12.207 7.987 -3.491 1.00 0.00 C ATOM 635 OE1 GLN A 38 11.698 8.999 -3.966 1.00 0.00 O ATOM 636 NE2 GLN A 38 13.239 8.077 -2.671 1.00 0.00 N ATOM 0 H GLN A 38 9.523 4.674 -1.046 1.00 0.00 H new ATOM 0 HA GLN A 38 11.772 4.140 -2.630 1.00 0.00 H new ATOM 0 HB2 GLN A 38 9.904 5.495 -3.412 1.00 0.00 H new ATOM 0 HB3 GLN A 38 10.287 6.747 -2.248 1.00 0.00 H new ATOM 0 HG2 GLN A 38 12.578 5.926 -3.954 1.00 0.00 H new ATOM 0 HG3 GLN A 38 11.242 6.631 -4.843 1.00 0.00 H new ATOM 0 HE21 GLN A 38 13.656 7.232 -2.281 1.00 0.00 H new ATOM 0 HE22 GLN A 38 13.619 8.992 -2.428 1.00 0.00 H new ATOM 645 N SER A 39 12.210 6.322 -0.129 1.00 0.00 N ATOM 646 CA SER A 39 13.179 6.971 0.737 1.00 0.00 C ATOM 647 C SER A 39 14.109 5.946 1.376 1.00 0.00 C ATOM 648 O SER A 39 15.287 6.229 1.567 1.00 0.00 O ATOM 649 CB SER A 39 12.415 7.774 1.781 1.00 0.00 C ATOM 650 OG SER A 39 11.641 8.765 1.132 1.00 0.00 O ATOM 0 H SER A 39 11.244 6.520 0.132 1.00 0.00 H new ATOM 0 HA SER A 39 13.814 7.643 0.159 1.00 0.00 H new ATOM 0 HB2 SER A 39 11.770 7.116 2.363 1.00 0.00 H new ATOM 0 HB3 SER A 39 13.110 8.239 2.480 1.00 0.00 H new ATOM 0 HG SER A 39 10.820 8.361 0.781 1.00 0.00 H new ATOM 656 N LYS A 40 13.605 4.755 1.718 1.00 0.00 N ATOM 657 CA LYS A 40 14.442 3.709 2.301 1.00 0.00 C ATOM 658 C LYS A 40 15.309 3.079 1.214 1.00 0.00 C ATOM 659 O LYS A 40 16.456 2.743 1.499 1.00 0.00 O ATOM 660 CB LYS A 40 13.612 2.635 3.021 1.00 0.00 C ATOM 661 CG LYS A 40 13.017 3.166 4.335 1.00 0.00 C ATOM 662 CD LYS A 40 12.375 2.072 5.198 1.00 0.00 C ATOM 663 CE LYS A 40 11.296 1.278 4.460 1.00 0.00 C ATOM 664 NZ LYS A 40 10.563 0.372 5.368 1.00 0.00 N ATOM 0 H LYS A 40 12.626 4.495 1.601 1.00 0.00 H new ATOM 0 HA LYS A 40 15.080 4.172 3.053 1.00 0.00 H new ATOM 0 HB2 LYS A 40 12.808 2.297 2.367 1.00 0.00 H new ATOM 0 HB3 LYS A 40 14.239 1.768 3.229 1.00 0.00 H new ATOM 0 HG2 LYS A 40 13.803 3.657 4.909 1.00 0.00 H new ATOM 0 HG3 LYS A 40 12.268 3.924 4.106 1.00 0.00 H new ATOM 0 HD2 LYS A 40 13.150 1.387 5.541 1.00 0.00 H new ATOM 0 HD3 LYS A 40 11.938 2.529 6.086 1.00 0.00 H new ATOM 0 HE2 LYS A 40 10.594 1.968 3.991 1.00 0.00 H new ATOM 0 HE3 LYS A 40 11.755 0.697 3.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 9.606 0.208 4.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 11.068 -0.535 5.436 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 10.498 0.804 6.312 1.00 0.00 H new ATOM 678 N ARG A 41 14.800 2.897 -0.011 1.00 0.00 N ATOM 679 CA ARG A 41 15.525 2.298 -1.130 1.00 0.00 C ATOM 680 C ARG A 41 16.564 3.232 -1.723 1.00 0.00 C ATOM 681 O ARG A 41 17.620 2.775 -2.135 1.00 0.00 O ATOM 682 CB ARG A 41 14.551 1.862 -2.240 1.00 0.00 C ATOM 683 CG ARG A 41 15.294 0.991 -3.270 1.00 0.00 C ATOM 684 CD ARG A 41 14.384 0.261 -4.253 1.00 0.00 C ATOM 685 NE ARG A 41 13.887 1.094 -5.358 1.00 0.00 N ATOM 686 CZ ARG A 41 13.343 0.585 -6.470 1.00 0.00 C ATOM 687 NH1 ARG A 41 13.223 -0.728 -6.627 1.00 0.00 N ATOM 688 NH2 ARG A 41 12.924 1.382 -7.434 1.00 0.00 N ATOM 0 H ARG A 41 13.848 3.171 -0.254 1.00 0.00 H new ATOM 0 HA ARG A 41 16.045 1.430 -0.725 1.00 0.00 H new ATOM 0 HB2 ARG A 41 13.720 1.304 -1.809 1.00 0.00 H new ATOM 0 HB3 ARG A 41 14.126 2.738 -2.729 1.00 0.00 H new ATOM 0 HG2 ARG A 41 15.983 1.622 -3.832 1.00 0.00 H new ATOM 0 HG3 ARG A 41 15.897 0.256 -2.738 1.00 0.00 H new ATOM 0 HD2 ARG A 41 14.927 -0.587 -4.670 1.00 0.00 H new ATOM 0 HD3 ARG A 41 13.531 -0.143 -3.708 1.00 0.00 H new ATOM 0 HE ARG A 41 13.960 2.108 -5.273 1.00 0.00 H new ATOM 0 HH11 ARG A 41 13.547 -1.361 -5.896 1.00 0.00 H new ATOM 0 HH12 ARG A 41 12.807 -1.104 -7.479 1.00 0.00 H new ATOM 0 HH21 ARG A 41 13.014 2.393 -7.335 1.00 0.00 H new ATOM 0 HH22 ARG A 41 12.510 0.987 -8.279 1.00 0.00 H new ATOM 702 N GLN A 42 16.297 4.523 -1.744 1.00 0.00 N ATOM 703 CA GLN A 42 17.152 5.561 -2.284 1.00 0.00 C ATOM 704 C GLN A 42 18.598 5.428 -1.813 1.00 0.00 C ATOM 705 O GLN A 42 19.438 5.284 -2.688 1.00 0.00 O ATOM 706 CB GLN A 42 16.547 6.952 -2.066 1.00 0.00 C ATOM 707 CG GLN A 42 17.327 8.047 -2.809 1.00 0.00 C ATOM 708 CD GLN A 42 17.327 7.851 -4.323 1.00 0.00 C ATOM 709 OE1 GLN A 42 16.383 8.243 -5.005 1.00 0.00 O ATOM 710 NE2 GLN A 42 18.345 7.214 -4.876 1.00 0.00 N ATOM 0 H GLN A 42 15.428 4.897 -1.363 1.00 0.00 H new ATOM 0 HA GLN A 42 17.201 5.424 -3.364 1.00 0.00 H new ATOM 0 HB2 GLN A 42 15.511 6.953 -2.405 1.00 0.00 H new ATOM 0 HB3 GLN A 42 16.534 7.178 -1.000 1.00 0.00 H new ATOM 0 HG2 GLN A 42 16.893 9.019 -2.573 1.00 0.00 H new ATOM 0 HG3 GLN A 42 18.356 8.061 -2.449 1.00 0.00 H new ATOM 0 HE21 GLN A 42 19.122 6.894 -4.297 1.00 0.00 H new ATOM 0 HE22 GLN A 42 18.354 7.042 -5.881 1.00 0.00 H new ATOM 719 N PRO A 43 18.939 5.402 -0.512 1.00 0.00 N ATOM 720 CA PRO A 43 20.326 5.264 -0.074 1.00 0.00 C ATOM 721 C PRO A 43 20.958 3.953 -0.550 1.00 0.00 C ATOM 722 O PRO A 43 22.183 3.899 -0.646 1.00 0.00 O ATOM 723 CB PRO A 43 20.296 5.325 1.459 1.00 0.00 C ATOM 724 CG PRO A 43 18.862 4.922 1.778 1.00 0.00 C ATOM 725 CD PRO A 43 18.080 5.548 0.640 1.00 0.00 C ATOM 0 HA PRO A 43 20.938 6.058 -0.501 1.00 0.00 H new ATOM 0 HB2 PRO A 43 21.018 4.642 1.906 1.00 0.00 H new ATOM 0 HB3 PRO A 43 20.529 6.323 1.830 1.00 0.00 H new ATOM 0 HG2 PRO A 43 18.742 3.839 1.804 1.00 0.00 H new ATOM 0 HG3 PRO A 43 18.541 5.302 2.748 1.00 0.00 H new ATOM 0 HD2 PRO A 43 17.125 5.044 0.490 1.00 0.00 H new ATOM 0 HD3 PRO A 43 17.859 6.596 0.840 1.00 0.00 H new ATOM 733 N ILE A 44 20.153 2.908 -0.774 1.00 0.00 N ATOM 734 CA ILE A 44 20.571 1.592 -1.235 1.00 0.00 C ATOM 735 C ILE A 44 20.932 1.678 -2.720 1.00 0.00 C ATOM 736 O ILE A 44 22.029 1.287 -3.109 1.00 0.00 O ATOM 737 CB ILE A 44 19.440 0.536 -1.048 1.00 0.00 C ATOM 738 CG1 ILE A 44 18.664 0.593 0.280 1.00 0.00 C ATOM 739 CG2 ILE A 44 20.045 -0.860 -1.247 1.00 0.00 C ATOM 740 CD1 ILE A 44 17.527 -0.434 0.364 1.00 0.00 C ATOM 0 H ILE A 44 19.145 2.967 -0.630 1.00 0.00 H new ATOM 0 HA ILE A 44 21.432 1.279 -0.644 1.00 0.00 H new ATOM 0 HB ILE A 44 18.686 0.775 -1.798 1.00 0.00 H new ATOM 0 HG12 ILE A 44 19.357 0.426 1.105 1.00 0.00 H new ATOM 0 HG13 ILE A 44 18.251 1.593 0.409 1.00 0.00 H new ATOM 0 HG21 ILE A 44 19.269 -1.614 -1.120 1.00 0.00 H new ATOM 0 HG22 ILE A 44 20.464 -0.935 -2.251 1.00 0.00 H new ATOM 0 HG23 ILE A 44 20.833 -1.023 -0.512 1.00 0.00 H new ATOM 0 HD11 ILE A 44 17.022 -0.340 1.325 1.00 0.00 H new ATOM 0 HD12 ILE A 44 16.814 -0.254 -0.440 1.00 0.00 H new ATOM 0 HD13 ILE A 44 17.937 -1.439 0.267 1.00 0.00 H new ATOM 752 N LEU A 45 20.015 2.184 -3.551 1.00 0.00 N ATOM 753 CA LEU A 45 20.226 2.307 -4.987 1.00 0.00 C ATOM 754 C LEU A 45 21.375 3.284 -5.250 1.00 0.00 C ATOM 755 O LEU A 45 22.252 3.001 -6.058 1.00 0.00 O ATOM 756 CB LEU A 45 18.885 2.569 -5.696 1.00 0.00 C ATOM 757 CG LEU A 45 18.384 4.011 -5.789 1.00 0.00 C ATOM 758 CD1 LEU A 45 18.843 4.628 -7.103 1.00 0.00 C ATOM 759 CD2 LEU A 45 16.853 4.074 -5.727 1.00 0.00 C ATOM 0 H LEU A 45 19.103 2.520 -3.240 1.00 0.00 H new ATOM 0 HA LEU A 45 20.567 1.377 -5.441 1.00 0.00 H new ATOM 0 HB2 LEU A 45 18.963 2.178 -6.710 1.00 0.00 H new ATOM 0 HB3 LEU A 45 18.120 1.983 -5.187 1.00 0.00 H new ATOM 0 HG LEU A 45 18.794 4.562 -4.943 1.00 0.00 H new ATOM 0 HD11 LEU A 45 18.485 5.655 -7.167 1.00 0.00 H new ATOM 0 HD12 LEU A 45 19.932 4.620 -7.148 1.00 0.00 H new ATOM 0 HD13 LEU A 45 18.441 4.051 -7.936 1.00 0.00 H new ATOM 0 HD21 LEU A 45 16.529 5.112 -5.796 1.00 0.00 H new ATOM 0 HD22 LEU A 45 16.432 3.507 -6.557 1.00 0.00 H new ATOM 0 HD23 LEU A 45 16.509 3.648 -4.784 1.00 0.00 H new ATOM 771 N ASP A 46 21.431 4.361 -4.473 1.00 0.00 N ATOM 772 CA ASP A 46 22.452 5.414 -4.508 1.00 0.00 C ATOM 773 C ASP A 46 23.805 4.808 -4.094 1.00 0.00 C ATOM 774 O ASP A 46 24.862 5.337 -4.427 1.00 0.00 O ATOM 775 CB ASP A 46 21.974 6.537 -3.577 1.00 0.00 C ATOM 776 CG ASP A 46 22.912 7.705 -3.288 1.00 0.00 C ATOM 777 OD1 ASP A 46 23.593 8.241 -4.185 1.00 0.00 O ATOM 778 OD2 ASP A 46 22.928 8.080 -2.092 1.00 0.00 O ATOM 0 H ASP A 46 20.725 4.537 -3.758 1.00 0.00 H new ATOM 0 HA ASP A 46 22.594 5.835 -5.504 1.00 0.00 H new ATOM 0 HB2 ASP A 46 21.057 6.948 -4.000 1.00 0.00 H new ATOM 0 HB3 ASP A 46 21.709 6.083 -2.622 1.00 0.00 H new ATOM 783 N ALA A 47 23.797 3.732 -3.289 1.00 0.00 N ATOM 784 CA ALA A 47 25.003 3.049 -2.842 1.00 0.00 C ATOM 785 C ALA A 47 25.542 2.113 -3.920 1.00 0.00 C ATOM 786 O ALA A 47 26.747 2.131 -4.130 1.00 0.00 O ATOM 787 CB ALA A 47 24.790 2.294 -1.522 1.00 0.00 C ATOM 0 H ALA A 47 22.938 3.314 -2.931 1.00 0.00 H new ATOM 0 HA ALA A 47 25.749 3.822 -2.655 1.00 0.00 H new ATOM 0 HB1 ALA A 47 25.718 1.801 -1.231 1.00 0.00 H new ATOM 0 HB2 ALA A 47 24.493 2.998 -0.744 1.00 0.00 H new ATOM 0 HB3 ALA A 47 24.008 1.546 -1.653 1.00 0.00 H new ATOM 793 N ILE A 48 24.726 1.280 -4.574 1.00 0.00 N ATOM 794 CA ILE A 48 25.245 0.394 -5.630 1.00 0.00 C ATOM 795 C ILE A 48 25.747 1.230 -6.796 1.00 0.00 C ATOM 796 O ILE A 48 26.701 0.846 -7.443 1.00 0.00 O ATOM 797 CB ILE A 48 24.249 -0.685 -6.085 1.00 0.00 C ATOM 798 CG1 ILE A 48 24.858 -1.659 -7.116 1.00 0.00 C ATOM 799 CG2 ILE A 48 22.923 -0.091 -6.558 1.00 0.00 C ATOM 800 CD1 ILE A 48 24.143 -3.018 -7.131 1.00 0.00 C ATOM 0 H ILE A 48 23.724 1.198 -4.399 1.00 0.00 H new ATOM 0 HA ILE A 48 26.077 -0.164 -5.200 1.00 0.00 H new ATOM 0 HB ILE A 48 24.022 -1.281 -5.201 1.00 0.00 H new ATOM 0 HG12 ILE A 48 24.805 -1.213 -8.109 1.00 0.00 H new ATOM 0 HG13 ILE A 48 25.914 -1.809 -6.890 1.00 0.00 H new ATOM 0 HG21 ILE A 48 22.255 -0.894 -6.869 1.00 0.00 H new ATOM 0 HG22 ILE A 48 22.464 0.469 -5.743 1.00 0.00 H new ATOM 0 HG23 ILE A 48 23.103 0.577 -7.400 1.00 0.00 H new ATOM 0 HD11 ILE A 48 24.609 -3.666 -7.873 1.00 0.00 H new ATOM 0 HD12 ILE A 48 24.219 -3.480 -6.147 1.00 0.00 H new ATOM 0 HD13 ILE A 48 23.093 -2.874 -7.384 1.00 0.00 H new ATOM 812 N GLU A 49 25.099 2.365 -7.058 1.00 0.00 N ATOM 813 CA GLU A 49 25.458 3.281 -8.130 1.00 0.00 C ATOM 814 C GLU A 49 26.843 3.897 -7.880 1.00 0.00 C ATOM 815 O GLU A 49 27.384 4.586 -8.743 1.00 0.00 O ATOM 816 CB GLU A 49 24.338 4.316 -8.327 1.00 0.00 C ATOM 817 CG GLU A 49 23.188 3.611 -9.061 1.00 0.00 C ATOM 818 CD GLU A 49 21.872 4.380 -9.136 1.00 0.00 C ATOM 819 OE1 GLU A 49 21.766 5.540 -8.681 1.00 0.00 O ATOM 820 OE2 GLU A 49 20.934 3.796 -9.734 1.00 0.00 O ATOM 0 H GLU A 49 24.293 2.676 -6.516 1.00 0.00 H new ATOM 0 HA GLU A 49 25.548 2.739 -9.071 1.00 0.00 H new ATOM 0 HB2 GLU A 49 24.000 4.704 -7.366 1.00 0.00 H new ATOM 0 HB3 GLU A 49 24.698 5.167 -8.905 1.00 0.00 H new ATOM 0 HG2 GLU A 49 23.514 3.388 -10.077 1.00 0.00 H new ATOM 0 HG3 GLU A 49 23.001 2.656 -8.570 1.00 0.00 H new ATOM 827 N ALA A 50 27.372 3.726 -6.663 1.00 0.00 N ATOM 828 CA ALA A 50 28.671 4.185 -6.219 1.00 0.00 C ATOM 829 C ALA A 50 29.670 3.009 -6.173 1.00 0.00 C ATOM 830 O ALA A 50 30.716 3.118 -5.522 1.00 0.00 O ATOM 831 CB ALA A 50 28.520 4.862 -4.850 1.00 0.00 C ATOM 0 H ALA A 50 26.866 3.233 -5.927 1.00 0.00 H new ATOM 0 HA ALA A 50 29.070 4.915 -6.923 1.00 0.00 H new ATOM 0 HB1 ALA A 50 29.494 5.211 -4.507 1.00 0.00 H new ATOM 0 HB2 ALA A 50 27.840 5.710 -4.936 1.00 0.00 H new ATOM 0 HB3 ALA A 50 28.118 4.146 -4.133 1.00 0.00 H new ATOM 837 N LYS A 51 29.331 1.861 -6.777 1.00 0.00 N ATOM 838 CA LYS A 51 30.096 0.626 -6.858 1.00 0.00 C ATOM 839 C LYS A 51 29.876 0.000 -8.235 1.00 0.00 C ATOM 840 O LYS A 51 30.423 -1.109 -8.428 1.00 0.00 O ATOM 841 CB LYS A 51 29.628 -0.359 -5.768 1.00 0.00 C ATOM 842 CG LYS A 51 29.584 0.269 -4.369 1.00 0.00 C ATOM 843 CD LYS A 51 29.166 -0.724 -3.281 1.00 0.00 C ATOM 844 CE LYS A 51 30.399 -1.414 -2.697 1.00 0.00 C ATOM 845 NZ LYS A 51 30.997 -0.625 -1.599 1.00 0.00 N ATOM 0 H LYS A 51 28.437 1.774 -7.260 1.00 0.00 H new ATOM 0 HA LYS A 51 31.154 0.843 -6.708 1.00 0.00 H new ATOM 0 HB2 LYS A 51 28.636 -0.731 -6.024 1.00 0.00 H new ATOM 0 HB3 LYS A 51 30.297 -1.220 -5.753 1.00 0.00 H new ATOM 0 HG2 LYS A 51 30.567 0.673 -4.127 1.00 0.00 H new ATOM 0 HG3 LYS A 51 28.888 1.108 -4.375 1.00 0.00 H new ATOM 0 HD2 LYS A 51 28.623 -0.204 -2.492 1.00 0.00 H new ATOM 0 HD3 LYS A 51 28.487 -1.468 -3.698 1.00 0.00 H new ATOM 0 HE2 LYS A 51 30.123 -2.401 -2.327 1.00 0.00 H new ATOM 0 HE3 LYS A 51 31.139 -1.563 -3.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 32.024 -0.784 -1.577 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 30.807 0.386 -1.754 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 30.581 -0.920 -0.693 1.00 0.00 H new TER 859 LYS A 51 ATOM 860 N GLY B 101 14.543 3.405 15.030 1.00 0.00 N ATOM 861 CA GLY B 101 14.694 3.102 13.605 1.00 0.00 C ATOM 862 C GLY B 101 16.158 3.132 13.215 1.00 0.00 C ATOM 863 O GLY B 101 16.817 4.166 13.332 1.00 0.00 O ATOM 0 HA2 GLY B 101 14.273 2.120 13.388 1.00 0.00 H new ATOM 0 HA3 GLY B 101 14.137 3.827 13.011 1.00 0.00 H new ATOM 867 N SER B 102 16.675 1.990 12.766 1.00 0.00 N ATOM 868 CA SER B 102 18.054 1.808 12.330 1.00 0.00 C ATOM 869 C SER B 102 18.356 2.644 11.079 1.00 0.00 C ATOM 870 O SER B 102 17.447 2.882 10.278 1.00 0.00 O ATOM 871 CB SER B 102 18.266 0.323 12.011 1.00 0.00 C ATOM 872 OG SER B 102 17.543 -0.504 12.911 1.00 0.00 O ATOM 0 H SER B 102 16.123 1.136 12.694 1.00 0.00 H new ATOM 0 HA SER B 102 18.724 2.136 13.125 1.00 0.00 H new ATOM 0 HB2 SER B 102 17.947 0.119 10.989 1.00 0.00 H new ATOM 0 HB3 SER B 102 19.328 0.084 12.067 1.00 0.00 H new ATOM 0 HG SER B 102 17.695 -1.445 12.684 1.00 0.00 H new ATOM 878 N ASP B 103 19.623 3.035 10.918 1.00 0.00 N ATOM 879 CA ASP B 103 20.122 3.833 9.796 1.00 0.00 C ATOM 880 C ASP B 103 20.428 2.964 8.583 1.00 0.00 C ATOM 881 O ASP B 103 20.570 1.747 8.715 1.00 0.00 O ATOM 882 CB ASP B 103 21.421 4.553 10.186 1.00 0.00 C ATOM 883 CG ASP B 103 21.147 5.678 11.167 1.00 0.00 C ATOM 884 OD1 ASP B 103 20.494 6.667 10.759 1.00 0.00 O ATOM 885 OD2 ASP B 103 21.534 5.503 12.343 1.00 0.00 O ATOM 0 H ASP B 103 20.354 2.796 11.588 1.00 0.00 H new ATOM 0 HA ASP B 103 19.339 4.550 9.548 1.00 0.00 H new ATOM 0 HB2 ASP B 103 22.117 3.841 10.630 1.00 0.00 H new ATOM 0 HB3 ASP B 103 21.901 4.953 9.293 1.00 0.00 H new ATOM 890 N TYR B 104 20.571 3.598 7.414 1.00 0.00 N ATOM 891 CA TYR B 104 20.879 2.934 6.144 1.00 0.00 C ATOM 892 C TYR B 104 21.830 3.761 5.266 1.00 0.00 C ATOM 893 O TYR B 104 22.252 3.309 4.207 1.00 0.00 O ATOM 894 CB TYR B 104 19.576 2.621 5.395 1.00 0.00 C ATOM 895 CG TYR B 104 18.743 1.537 6.054 1.00 0.00 C ATOM 896 CD1 TYR B 104 17.861 1.871 7.096 1.00 0.00 C ATOM 897 CD2 TYR B 104 18.889 0.189 5.670 1.00 0.00 C ATOM 898 CE1 TYR B 104 17.130 0.863 7.742 1.00 0.00 C ATOM 899 CE2 TYR B 104 18.119 -0.813 6.287 1.00 0.00 C ATOM 900 CZ TYR B 104 17.223 -0.475 7.318 1.00 0.00 C ATOM 901 OH TYR B 104 16.464 -1.427 7.929 1.00 0.00 O ATOM 0 H TYR B 104 20.474 4.609 7.323 1.00 0.00 H new ATOM 0 HA TYR B 104 21.399 2.003 6.372 1.00 0.00 H new ATOM 0 HB2 TYR B 104 18.981 3.531 5.322 1.00 0.00 H new ATOM 0 HB3 TYR B 104 19.816 2.315 4.377 1.00 0.00 H new ATOM 0 HD1 TYR B 104 17.746 2.901 7.399 1.00 0.00 H new ATOM 0 HD2 TYR B 104 19.596 -0.076 4.898 1.00 0.00 H new ATOM 0 HE1 TYR B 104 16.489 1.117 8.573 1.00 0.00 H new ATOM 0 HE2 TYR B 104 18.215 -1.841 5.970 1.00 0.00 H new ATOM 0 HH TYR B 104 16.643 -2.300 7.520 1.00 0.00 H new ATOM 911 N GLU B 105 22.200 4.977 5.667 1.00 0.00 N ATOM 912 CA GLU B 105 23.107 5.825 4.889 1.00 0.00 C ATOM 913 C GLU B 105 24.519 5.225 4.819 1.00 0.00 C ATOM 914 O GLU B 105 25.261 5.509 3.882 1.00 0.00 O ATOM 915 CB GLU B 105 23.113 7.221 5.523 1.00 0.00 C ATOM 916 CG GLU B 105 21.803 7.967 5.209 1.00 0.00 C ATOM 917 CD GLU B 105 21.537 9.119 6.177 1.00 0.00 C ATOM 918 OE1 GLU B 105 22.329 10.089 6.207 1.00 0.00 O ATOM 919 OE2 GLU B 105 20.536 9.035 6.932 1.00 0.00 O ATOM 0 H GLU B 105 21.881 5.402 6.538 1.00 0.00 H new ATOM 0 HA GLU B 105 22.758 5.893 3.859 1.00 0.00 H new ATOM 0 HB2 GLU B 105 23.239 7.135 6.602 1.00 0.00 H new ATOM 0 HB3 GLU B 105 23.962 7.793 5.148 1.00 0.00 H new ATOM 0 HG2 GLU B 105 21.845 8.355 4.191 1.00 0.00 H new ATOM 0 HG3 GLU B 105 20.971 7.264 5.248 1.00 0.00 H new ATOM 926 N PHE B 106 24.887 4.370 5.775 1.00 0.00 N ATOM 927 CA PHE B 106 26.189 3.712 5.841 1.00 0.00 C ATOM 928 C PHE B 106 26.336 2.636 4.757 1.00 0.00 C ATOM 929 O PHE B 106 27.425 2.081 4.595 1.00 0.00 O ATOM 930 CB PHE B 106 26.431 3.159 7.258 1.00 0.00 C ATOM 931 CG PHE B 106 26.946 4.190 8.250 1.00 0.00 C ATOM 932 CD1 PHE B 106 26.182 5.331 8.564 1.00 0.00 C ATOM 933 CD2 PHE B 106 28.220 4.030 8.833 1.00 0.00 C ATOM 934 CE1 PHE B 106 26.709 6.324 9.406 1.00 0.00 C ATOM 935 CE2 PHE B 106 28.728 5.007 9.708 1.00 0.00 C ATOM 936 CZ PHE B 106 27.979 6.163 9.985 1.00 0.00 C ATOM 0 H PHE B 106 24.270 4.111 6.544 1.00 0.00 H new ATOM 0 HA PHE B 106 26.963 4.451 5.637 1.00 0.00 H new ATOM 0 HB2 PHE B 106 25.498 2.741 7.637 1.00 0.00 H new ATOM 0 HB3 PHE B 106 27.147 2.339 7.199 1.00 0.00 H new ATOM 0 HD1 PHE B 106 25.188 5.443 8.156 1.00 0.00 H new ATOM 0 HD2 PHE B 106 28.808 3.153 8.607 1.00 0.00 H new ATOM 0 HE1 PHE B 106 26.135 7.216 9.609 1.00 0.00 H new ATOM 0 HE2 PHE B 106 29.695 4.868 10.168 1.00 0.00 H new ATOM 0 HZ PHE B 106 28.377 6.924 10.640 1.00 0.00 H new ATOM 946 N LEU B 107 25.284 2.357 3.971 1.00 0.00 N ATOM 947 CA LEU B 107 25.312 1.370 2.892 1.00 0.00 C ATOM 948 C LEU B 107 26.405 1.708 1.878 1.00 0.00 C ATOM 949 O LEU B 107 26.838 0.827 1.139 1.00 0.00 O ATOM 950 CB LEU B 107 23.952 1.299 2.176 1.00 0.00 C ATOM 951 CG LEU B 107 22.900 0.504 2.967 1.00 0.00 C ATOM 952 CD1 LEU B 107 21.514 0.776 2.391 1.00 0.00 C ATOM 953 CD2 LEU B 107 23.126 -1.009 2.877 1.00 0.00 C ATOM 0 H LEU B 107 24.381 2.819 4.072 1.00 0.00 H new ATOM 0 HA LEU B 107 25.527 0.399 3.339 1.00 0.00 H new ATOM 0 HB2 LEU B 107 23.583 2.311 2.006 1.00 0.00 H new ATOM 0 HB3 LEU B 107 24.086 0.840 1.197 1.00 0.00 H new ATOM 0 HG LEU B 107 22.984 0.823 4.006 1.00 0.00 H new ATOM 0 HD11 LEU B 107 20.769 0.212 2.953 1.00 0.00 H new ATOM 0 HD12 LEU B 107 21.293 1.841 2.463 1.00 0.00 H new ATOM 0 HD13 LEU B 107 21.488 0.470 1.345 1.00 0.00 H new ATOM 0 HD21 LEU B 107 22.358 -1.526 3.452 1.00 0.00 H new ATOM 0 HD22 LEU B 107 23.073 -1.323 1.835 1.00 0.00 H new ATOM 0 HD23 LEU B 107 24.108 -1.255 3.281 1.00 0.00 H new ATOM 965 N LYS B 108 26.853 2.968 1.831 1.00 0.00 N ATOM 966 CA LYS B 108 27.914 3.404 0.929 1.00 0.00 C ATOM 967 C LYS B 108 29.215 2.653 1.203 1.00 0.00 C ATOM 968 O LYS B 108 30.017 2.484 0.285 1.00 0.00 O ATOM 969 CB LYS B 108 28.144 4.916 1.085 1.00 0.00 C ATOM 970 CG LYS B 108 26.932 5.795 0.740 1.00 0.00 C ATOM 971 CD LYS B 108 26.455 5.561 -0.694 1.00 0.00 C ATOM 972 CE LYS B 108 25.325 6.482 -1.148 1.00 0.00 C ATOM 973 NZ LYS B 108 24.065 6.307 -0.402 1.00 0.00 N ATOM 0 H LYS B 108 26.485 3.714 2.422 1.00 0.00 H new ATOM 0 HA LYS B 108 27.602 3.185 -0.092 1.00 0.00 H new ATOM 0 HB2 LYS B 108 28.440 5.119 2.114 1.00 0.00 H new ATOM 0 HB3 LYS B 108 28.979 5.209 0.449 1.00 0.00 H new ATOM 0 HG2 LYS B 108 26.119 5.582 1.434 1.00 0.00 H new ATOM 0 HG3 LYS B 108 27.195 6.845 0.870 1.00 0.00 H new ATOM 0 HD2 LYS B 108 27.301 5.687 -1.369 1.00 0.00 H new ATOM 0 HD3 LYS B 108 26.123 4.527 -0.788 1.00 0.00 H new ATOM 0 HE2 LYS B 108 25.653 7.517 -1.048 1.00 0.00 H new ATOM 0 HE3 LYS B 108 25.134 6.309 -2.207 1.00 0.00 H new ATOM 0 HZ1 LYS B 108 23.360 6.990 -0.746 1.00 0.00 H new ATOM 0 HZ2 LYS B 108 23.709 5.340 -0.544 1.00 0.00 H new ATOM 0 HZ3 LYS B 108 24.236 6.467 0.611 1.00 0.00 H new ATOM 987 N SER B 109 29.427 2.213 2.443 1.00 0.00 N ATOM 988 CA SER B 109 30.611 1.479 2.863 1.00 0.00 C ATOM 989 C SER B 109 30.370 -0.034 2.864 1.00 0.00 C ATOM 990 O SER B 109 31.327 -0.796 3.000 1.00 0.00 O ATOM 991 CB SER B 109 31.017 1.947 4.265 1.00 0.00 C ATOM 992 OG SER B 109 31.369 3.318 4.246 1.00 0.00 O ATOM 0 H SER B 109 28.760 2.363 3.200 1.00 0.00 H new ATOM 0 HA SER B 109 31.412 1.681 2.152 1.00 0.00 H new ATOM 0 HB2 SER B 109 30.194 1.786 4.961 1.00 0.00 H new ATOM 0 HB3 SER B 109 31.858 1.354 4.624 1.00 0.00 H new ATOM 0 HG SER B 109 31.624 3.603 5.148 1.00 0.00 H new ATOM 998 N TRP B 110 29.118 -0.494 2.761 1.00 0.00 N ATOM 999 CA TRP B 110 28.808 -1.920 2.752 1.00 0.00 C ATOM 1000 C TRP B 110 29.232 -2.538 1.415 1.00 0.00 C ATOM 1001 O TRP B 110 29.563 -1.833 0.452 1.00 0.00 O ATOM 1002 CB TRP B 110 27.306 -2.135 2.998 1.00 0.00 C ATOM 1003 CG TRP B 110 26.772 -1.950 4.401 1.00 0.00 C ATOM 1004 CD1 TRP B 110 25.566 -2.419 4.787 1.00 0.00 C ATOM 1005 CD2 TRP B 110 27.339 -1.325 5.609 1.00 0.00 C ATOM 1006 NE1 TRP B 110 25.300 -2.058 6.086 1.00 0.00 N ATOM 1007 CE2 TRP B 110 26.346 -1.358 6.638 1.00 0.00 C ATOM 1008 CE3 TRP B 110 28.581 -0.757 5.978 1.00 0.00 C ATOM 1009 CZ2 TRP B 110 26.542 -0.792 7.907 1.00 0.00 C ATOM 1010 CZ3 TRP B 110 28.792 -0.181 7.245 1.00 0.00 C ATOM 1011 CH2 TRP B 110 27.767 -0.177 8.202 1.00 0.00 C ATOM 0 H TRP B 110 28.300 0.110 2.682 1.00 0.00 H new ATOM 0 HA TRP B 110 29.361 -2.412 3.552 1.00 0.00 H new ATOM 0 HB2 TRP B 110 26.762 -1.454 2.343 1.00 0.00 H new ATOM 0 HB3 TRP B 110 27.059 -3.148 2.680 1.00 0.00 H new ATOM 0 HD1 TRP B 110 24.902 -2.998 4.162 1.00 0.00 H new ATOM 0 HE1 TRP B 110 24.435 -2.281 6.578 1.00 0.00 H new ATOM 0 HE3 TRP B 110 29.393 -0.766 5.265 1.00 0.00 H new ATOM 0 HZ2 TRP B 110 25.758 -0.830 8.648 1.00 0.00 H new ATOM 0 HZ3 TRP B 110 29.749 0.260 7.481 1.00 0.00 H new ATOM 0 HH2 TRP B 110 27.920 0.297 9.160 1.00 0.00 H new ATOM 1022 N THR B 111 29.291 -3.868 1.354 1.00 0.00 N ATOM 1023 CA THR B 111 29.652 -4.562 0.131 1.00 0.00 C ATOM 1024 C THR B 111 28.460 -4.470 -0.825 1.00 0.00 C ATOM 1025 O THR B 111 27.320 -4.224 -0.409 1.00 0.00 O ATOM 1026 CB THR B 111 30.032 -6.024 0.437 1.00 0.00 C ATOM 1027 OG1 THR B 111 29.124 -6.604 1.345 1.00 0.00 O ATOM 1028 CG2 THR B 111 31.436 -6.117 1.026 1.00 0.00 C ATOM 0 H THR B 111 29.092 -4.483 2.143 1.00 0.00 H new ATOM 0 HA THR B 111 30.524 -4.103 -0.334 1.00 0.00 H new ATOM 0 HB THR B 111 29.999 -6.565 -0.509 1.00 0.00 H new ATOM 0 HG1 THR B 111 29.386 -7.532 1.522 1.00 0.00 H new ATOM 0 HG21 THR B 111 31.676 -7.160 1.232 1.00 0.00 H new ATOM 0 HG22 THR B 111 32.156 -5.712 0.315 1.00 0.00 H new ATOM 0 HG23 THR B 111 31.480 -5.545 1.953 1.00 0.00 H new ATOM 1036 N VAL B 112 28.722 -4.658 -2.121 1.00 0.00 N ATOM 1037 CA VAL B 112 27.657 -4.614 -3.109 1.00 0.00 C ATOM 1038 C VAL B 112 26.649 -5.727 -2.798 1.00 0.00 C ATOM 1039 O VAL B 112 25.453 -5.530 -2.973 1.00 0.00 O ATOM 1040 CB VAL B 112 28.247 -4.647 -4.533 1.00 0.00 C ATOM 1041 CG1 VAL B 112 29.025 -5.932 -4.853 1.00 0.00 C ATOM 1042 CG2 VAL B 112 27.155 -4.410 -5.575 1.00 0.00 C ATOM 0 H VAL B 112 29.651 -4.839 -2.501 1.00 0.00 H new ATOM 0 HA VAL B 112 27.104 -3.676 -3.059 1.00 0.00 H new ATOM 0 HB VAL B 112 28.973 -3.835 -4.574 1.00 0.00 H new ATOM 0 HG11 VAL B 112 29.409 -5.881 -5.872 1.00 0.00 H new ATOM 0 HG12 VAL B 112 29.857 -6.037 -4.156 1.00 0.00 H new ATOM 0 HG13 VAL B 112 28.362 -6.792 -4.758 1.00 0.00 H new ATOM 0 HG21 VAL B 112 27.592 -4.437 -6.573 1.00 0.00 H new ATOM 0 HG22 VAL B 112 26.396 -5.188 -5.490 1.00 0.00 H new ATOM 0 HG23 VAL B 112 26.696 -3.436 -5.406 1.00 0.00 H new ATOM 1052 N GLU B 113 27.101 -6.861 -2.252 1.00 0.00 N ATOM 1053 CA GLU B 113 26.209 -7.961 -1.929 1.00 0.00 C ATOM 1054 C GLU B 113 25.239 -7.557 -0.819 1.00 0.00 C ATOM 1055 O GLU B 113 24.026 -7.646 -0.982 1.00 0.00 O ATOM 1056 CB GLU B 113 27.000 -9.170 -1.422 1.00 0.00 C ATOM 1057 CG GLU B 113 28.056 -9.746 -2.369 1.00 0.00 C ATOM 1058 CD GLU B 113 28.505 -11.121 -1.856 1.00 0.00 C ATOM 1059 OE1 GLU B 113 28.526 -11.329 -0.621 1.00 0.00 O ATOM 1060 OE2 GLU B 113 28.700 -12.036 -2.685 1.00 0.00 O ATOM 0 H GLU B 113 28.081 -7.034 -2.027 1.00 0.00 H new ATOM 0 HA GLU B 113 25.668 -8.214 -2.840 1.00 0.00 H new ATOM 0 HB2 GLU B 113 27.494 -8.888 -0.492 1.00 0.00 H new ATOM 0 HB3 GLU B 113 26.292 -9.962 -1.179 1.00 0.00 H new ATOM 0 HG2 GLU B 113 27.647 -9.837 -3.375 1.00 0.00 H new ATOM 0 HG3 GLU B 113 28.910 -9.072 -2.432 1.00 0.00 H new ATOM 1067 N ASP B 114 25.775 -7.072 0.304 1.00 0.00 N ATOM 1068 CA ASP B 114 24.977 -6.693 1.465 1.00 0.00 C ATOM 1069 C ASP B 114 23.960 -5.612 1.170 1.00 0.00 C ATOM 1070 O ASP B 114 22.856 -5.643 1.720 1.00 0.00 O ATOM 1071 CB ASP B 114 25.885 -6.221 2.612 1.00 0.00 C ATOM 1072 CG ASP B 114 25.787 -7.096 3.851 1.00 0.00 C ATOM 1073 OD1 ASP B 114 25.695 -8.342 3.740 1.00 0.00 O ATOM 1074 OD2 ASP B 114 25.790 -6.524 4.965 1.00 0.00 O ATOM 0 H ASP B 114 26.777 -6.932 0.431 1.00 0.00 H new ATOM 0 HA ASP B 114 24.429 -7.590 1.753 1.00 0.00 H new ATOM 0 HB2 ASP B 114 26.919 -6.206 2.266 1.00 0.00 H new ATOM 0 HB3 ASP B 114 25.623 -5.197 2.877 1.00 0.00 H new ATOM 1079 N LEU B 115 24.329 -4.632 0.344 1.00 0.00 N ATOM 1080 CA LEU B 115 23.414 -3.556 -0.001 1.00 0.00 C ATOM 1081 C LEU B 115 22.353 -4.104 -0.966 1.00 0.00 C ATOM 1082 O LEU B 115 21.159 -3.853 -0.784 1.00 0.00 O ATOM 1083 CB LEU B 115 24.190 -2.301 -0.474 1.00 0.00 C ATOM 1084 CG LEU B 115 24.530 -2.280 -1.973 1.00 0.00 C ATOM 1085 CD1 LEU B 115 23.314 -1.843 -2.793 1.00 0.00 C ATOM 1086 CD2 LEU B 115 25.699 -1.356 -2.304 1.00 0.00 C ATOM 0 H LEU B 115 25.248 -4.565 -0.093 1.00 0.00 H new ATOM 0 HA LEU B 115 22.865 -3.197 0.870 1.00 0.00 H new ATOM 0 HB2 LEU B 115 23.600 -1.416 -0.237 1.00 0.00 H new ATOM 0 HB3 LEU B 115 25.117 -2.228 0.095 1.00 0.00 H new ATOM 0 HG LEU B 115 24.820 -3.298 -2.231 1.00 0.00 H new ATOM 0 HD11 LEU B 115 23.573 -1.834 -3.852 1.00 0.00 H new ATOM 0 HD12 LEU B 115 22.493 -2.540 -2.626 1.00 0.00 H new ATOM 0 HD13 LEU B 115 23.008 -0.843 -2.486 1.00 0.00 H new ATOM 0 HD21 LEU B 115 25.892 -1.383 -3.376 1.00 0.00 H new ATOM 0 HD22 LEU B 115 25.453 -0.337 -2.005 1.00 0.00 H new ATOM 0 HD23 LEU B 115 26.588 -1.687 -1.767 1.00 0.00 H new ATOM 1098 N GLN B 116 22.761 -4.891 -1.970 1.00 0.00 N ATOM 1099 CA GLN B 116 21.862 -5.472 -2.957 1.00 0.00 C ATOM 1100 C GLN B 116 20.840 -6.373 -2.269 1.00 0.00 C ATOM 1101 O GLN B 116 19.670 -6.373 -2.647 1.00 0.00 O ATOM 1102 CB GLN B 116 22.682 -6.213 -4.015 1.00 0.00 C ATOM 1103 CG GLN B 116 21.825 -6.812 -5.129 1.00 0.00 C ATOM 1104 CD GLN B 116 22.730 -7.321 -6.242 1.00 0.00 C ATOM 1105 OE1 GLN B 116 23.264 -8.428 -6.172 1.00 0.00 O ATOM 1106 NE2 GLN B 116 22.938 -6.527 -7.272 1.00 0.00 N ATOM 0 H GLN B 116 23.739 -5.141 -2.115 1.00 0.00 H new ATOM 0 HA GLN B 116 21.300 -4.688 -3.464 1.00 0.00 H new ATOM 0 HB2 GLN B 116 23.406 -5.525 -4.452 1.00 0.00 H new ATOM 0 HB3 GLN B 116 23.250 -7.009 -3.534 1.00 0.00 H new ATOM 0 HG2 GLN B 116 21.217 -7.628 -4.737 1.00 0.00 H new ATOM 0 HG3 GLN B 116 21.138 -6.061 -5.518 1.00 0.00 H new ATOM 0 HE21 GLN B 116 22.486 -5.613 -7.311 1.00 0.00 H new ATOM 0 HE22 GLN B 116 23.551 -6.826 -8.031 1.00 0.00 H new ATOM 1115 N LYS B 117 21.235 -7.082 -1.207 1.00 0.00 N ATOM 1116 CA LYS B 117 20.338 -7.960 -0.460 1.00 0.00 C ATOM 1117 C LYS B 117 19.170 -7.149 0.094 1.00 0.00 C ATOM 1118 O LYS B 117 18.069 -7.691 0.231 1.00 0.00 O ATOM 1119 CB LYS B 117 21.121 -8.735 0.621 1.00 0.00 C ATOM 1120 CG LYS B 117 21.399 -10.185 0.189 1.00 0.00 C ATOM 1121 CD LYS B 117 22.216 -10.331 -1.110 1.00 0.00 C ATOM 1122 CE LYS B 117 23.643 -10.844 -0.913 1.00 0.00 C ATOM 1123 NZ LYS B 117 23.717 -12.269 -0.539 1.00 0.00 N ATOM 0 H LYS B 117 22.188 -7.061 -0.843 1.00 0.00 H new ATOM 0 HA LYS B 117 19.912 -8.715 -1.121 1.00 0.00 H new ATOM 0 HB2 LYS B 117 22.064 -8.227 0.822 1.00 0.00 H new ATOM 0 HB3 LYS B 117 20.554 -8.734 1.552 1.00 0.00 H new ATOM 0 HG2 LYS B 117 21.930 -10.693 0.994 1.00 0.00 H new ATOM 0 HG3 LYS B 117 20.447 -10.699 0.062 1.00 0.00 H new ATOM 0 HD2 LYS B 117 21.689 -11.011 -1.780 1.00 0.00 H new ATOM 0 HD3 LYS B 117 22.258 -9.362 -1.607 1.00 0.00 H new ATOM 0 HE2 LYS B 117 24.205 -10.690 -1.834 1.00 0.00 H new ATOM 0 HE3 LYS B 117 24.129 -10.249 -0.140 1.00 0.00 H new ATOM 0 HZ1 LYS B 117 24.713 -12.546 -0.423 1.00 0.00 H new ATOM 0 HZ2 LYS B 117 23.209 -12.420 0.356 1.00 0.00 H new ATOM 0 HZ3 LYS B 117 23.282 -12.847 -1.286 1.00 0.00 H new ATOM 1137 N ARG B 118 19.379 -5.884 0.472 1.00 0.00 N ATOM 1138 CA ARG B 118 18.303 -5.031 0.970 1.00 0.00 C ATOM 1139 C ARG B 118 17.461 -4.543 -0.200 1.00 0.00 C ATOM 1140 O ARG B 118 16.239 -4.502 -0.090 1.00 0.00 O ATOM 1141 CB ARG B 118 18.842 -3.846 1.772 1.00 0.00 C ATOM 1142 CG ARG B 118 19.675 -4.324 2.961 1.00 0.00 C ATOM 1143 CD ARG B 118 19.679 -3.256 4.051 1.00 0.00 C ATOM 1144 NE ARG B 118 20.476 -3.679 5.208 1.00 0.00 N ATOM 1145 CZ ARG B 118 20.138 -4.591 6.124 1.00 0.00 C ATOM 1146 NH1 ARG B 118 18.956 -5.196 6.101 1.00 0.00 N ATOM 1147 NH2 ARG B 118 21.005 -4.913 7.071 1.00 0.00 N ATOM 0 H ARG B 118 20.291 -5.429 0.441 1.00 0.00 H new ATOM 0 HA ARG B 118 17.684 -5.622 1.646 1.00 0.00 H new ATOM 0 HB2 ARG B 118 19.452 -3.213 1.127 1.00 0.00 H new ATOM 0 HB3 ARG B 118 18.012 -3.235 2.127 1.00 0.00 H new ATOM 0 HG2 ARG B 118 19.266 -5.255 3.353 1.00 0.00 H new ATOM 0 HG3 ARG B 118 20.696 -4.534 2.641 1.00 0.00 H new ATOM 0 HD2 ARG B 118 20.081 -2.326 3.650 1.00 0.00 H new ATOM 0 HD3 ARG B 118 18.656 -3.051 4.367 1.00 0.00 H new ATOM 0 HE ARG B 118 21.384 -3.229 5.325 1.00 0.00 H new ATOM 0 HH11 ARG B 118 18.280 -4.968 5.372 1.00 0.00 H new ATOM 0 HH12 ARG B 118 18.724 -5.889 6.813 1.00 0.00 H new ATOM 0 HH21 ARG B 118 21.921 -4.466 7.097 1.00 0.00 H new ATOM 0 HH22 ARG B 118 20.757 -5.608 7.775 1.00 0.00 H new ATOM 1161 N LEU B 119 18.102 -4.176 -1.319 1.00 0.00 N ATOM 1162 CA LEU B 119 17.418 -3.692 -2.516 1.00 0.00 C ATOM 1163 C LEU B 119 16.441 -4.750 -3.018 1.00 0.00 C ATOM 1164 O LEU B 119 15.266 -4.453 -3.219 1.00 0.00 O ATOM 1165 CB LEU B 119 18.432 -3.291 -3.606 1.00 0.00 C ATOM 1166 CG LEU B 119 17.791 -2.414 -4.705 1.00 0.00 C ATOM 1167 CD1 LEU B 119 18.817 -1.398 -5.218 1.00 0.00 C ATOM 1168 CD2 LEU B 119 17.257 -3.245 -5.876 1.00 0.00 C ATOM 0 H LEU B 119 19.117 -4.209 -1.415 1.00 0.00 H new ATOM 0 HA LEU B 119 16.850 -2.797 -2.262 1.00 0.00 H new ATOM 0 HB2 LEU B 119 19.260 -2.750 -3.148 1.00 0.00 H new ATOM 0 HB3 LEU B 119 18.851 -4.190 -4.059 1.00 0.00 H new ATOM 0 HG LEU B 119 16.942 -1.898 -4.257 1.00 0.00 H new ATOM 0 HD11 LEU B 119 18.362 -0.781 -5.993 1.00 0.00 H new ATOM 0 HD12 LEU B 119 19.144 -0.763 -4.394 1.00 0.00 H new ATOM 0 HD13 LEU B 119 19.676 -1.926 -5.632 1.00 0.00 H new ATOM 0 HD21 LEU B 119 16.817 -2.583 -6.621 1.00 0.00 H new ATOM 0 HD22 LEU B 119 18.076 -3.806 -6.327 1.00 0.00 H new ATOM 0 HD23 LEU B 119 16.498 -3.939 -5.514 1.00 0.00 H new ATOM 1180 N LEU B 120 16.904 -5.990 -3.191 1.00 0.00 N ATOM 1181 CA LEU B 120 16.050 -7.074 -3.665 1.00 0.00 C ATOM 1182 C LEU B 120 14.914 -7.290 -2.672 1.00 0.00 C ATOM 1183 O LEU B 120 13.780 -7.434 -3.097 1.00 0.00 O ATOM 1184 CB LEU B 120 16.847 -8.361 -3.974 1.00 0.00 C ATOM 1185 CG LEU B 120 17.066 -9.335 -2.801 1.00 0.00 C ATOM 1186 CD1 LEU B 120 15.930 -10.361 -2.661 1.00 0.00 C ATOM 1187 CD2 LEU B 120 18.377 -10.105 -2.979 1.00 0.00 C ATOM 0 H LEU B 120 17.869 -6.266 -3.008 1.00 0.00 H new ATOM 0 HA LEU B 120 15.612 -6.788 -4.621 1.00 0.00 H new ATOM 0 HB2 LEU B 120 16.332 -8.898 -4.771 1.00 0.00 H new ATOM 0 HB3 LEU B 120 17.823 -8.072 -4.364 1.00 0.00 H new ATOM 0 HG LEU B 120 17.094 -8.720 -1.902 1.00 0.00 H new ATOM 0 HD11 LEU B 120 16.138 -11.021 -1.819 1.00 0.00 H new ATOM 0 HD12 LEU B 120 14.988 -9.840 -2.490 1.00 0.00 H new ATOM 0 HD13 LEU B 120 15.858 -10.951 -3.575 1.00 0.00 H new ATOM 0 HD21 LEU B 120 18.514 -10.788 -2.141 1.00 0.00 H new ATOM 0 HD22 LEU B 120 18.342 -10.674 -3.908 1.00 0.00 H new ATOM 0 HD23 LEU B 120 19.210 -9.402 -3.015 1.00 0.00 H new ATOM 1199 N ALA B 121 15.189 -7.252 -1.362 1.00 0.00 N ATOM 1200 CA ALA B 121 14.187 -7.452 -0.320 1.00 0.00 C ATOM 1201 C ALA B 121 13.130 -6.349 -0.340 1.00 0.00 C ATOM 1202 O ALA B 121 11.983 -6.603 0.030 1.00 0.00 O ATOM 1203 CB ALA B 121 14.864 -7.526 1.052 1.00 0.00 C ATOM 0 H ALA B 121 16.126 -7.079 -0.997 1.00 0.00 H new ATOM 0 HA ALA B 121 13.678 -8.396 -0.516 1.00 0.00 H new ATOM 0 HB1 ALA B 121 14.108 -7.675 1.823 1.00 0.00 H new ATOM 0 HB2 ALA B 121 15.567 -8.359 1.067 1.00 0.00 H new ATOM 0 HB3 ALA B 121 15.400 -6.596 1.244 1.00 0.00 H new ATOM 1209 N LEU B 122 13.495 -5.144 -0.777 1.00 0.00 N ATOM 1210 CA LEU B 122 12.612 -3.990 -0.883 1.00 0.00 C ATOM 1211 C LEU B 122 11.510 -4.264 -1.905 1.00 0.00 C ATOM 1212 O LEU B 122 10.446 -3.649 -1.825 1.00 0.00 O ATOM 1213 CB LEU B 122 13.393 -2.714 -1.275 1.00 0.00 C ATOM 1214 CG LEU B 122 13.304 -1.540 -0.288 1.00 0.00 C ATOM 1215 CD1 LEU B 122 11.868 -1.059 -0.061 1.00 0.00 C ATOM 1216 CD2 LEU B 122 13.976 -1.903 1.037 1.00 0.00 C ATOM 0 H LEU B 122 14.448 -4.941 -1.077 1.00 0.00 H new ATOM 0 HA LEU B 122 12.163 -3.821 0.096 1.00 0.00 H new ATOM 0 HB2 LEU B 122 14.443 -2.979 -1.400 1.00 0.00 H new ATOM 0 HB3 LEU B 122 13.032 -2.375 -2.246 1.00 0.00 H new ATOM 0 HG LEU B 122 13.839 -0.705 -0.740 1.00 0.00 H new ATOM 0 HD11 LEU B 122 11.870 -0.229 0.645 1.00 0.00 H new ATOM 0 HD12 LEU B 122 11.441 -0.729 -1.008 1.00 0.00 H new ATOM 0 HD13 LEU B 122 11.270 -1.876 0.342 1.00 0.00 H new ATOM 0 HD21 LEU B 122 13.904 -1.060 1.724 1.00 0.00 H new ATOM 0 HD22 LEU B 122 13.478 -2.770 1.472 1.00 0.00 H new ATOM 0 HD23 LEU B 122 15.026 -2.138 0.860 1.00 0.00 H new ATOM 1228 N ASP B 123 11.769 -5.103 -2.915 1.00 0.00 N ATOM 1229 CA ASP B 123 10.777 -5.414 -3.948 1.00 0.00 C ATOM 1230 C ASP B 123 9.605 -6.215 -3.377 1.00 0.00 C ATOM 1231 O ASP B 123 8.495 -5.688 -3.425 1.00 0.00 O ATOM 1232 CB ASP B 123 11.420 -5.977 -5.228 1.00 0.00 C ATOM 1233 CG ASP B 123 11.861 -4.861 -6.192 1.00 0.00 C ATOM 1234 OD1 ASP B 123 11.758 -3.652 -5.861 1.00 0.00 O ATOM 1235 OD2 ASP B 123 12.366 -5.151 -7.301 1.00 0.00 O ATOM 0 H ASP B 123 12.662 -5.580 -3.038 1.00 0.00 H new ATOM 0 HA ASP B 123 10.325 -4.482 -4.287 1.00 0.00 H new ATOM 0 HB2 ASP B 123 12.283 -6.588 -4.962 1.00 0.00 H new ATOM 0 HB3 ASP B 123 10.710 -6.632 -5.733 1.00 0.00 H new ATOM 1240 N PRO B 124 9.751 -7.409 -2.780 1.00 0.00 N ATOM 1241 CA PRO B 124 8.603 -8.102 -2.225 1.00 0.00 C ATOM 1242 C PRO B 124 8.057 -7.372 -0.979 1.00 0.00 C ATOM 1243 O PRO B 124 6.944 -7.674 -0.559 1.00 0.00 O ATOM 1244 CB PRO B 124 9.060 -9.531 -1.940 1.00 0.00 C ATOM 1245 CG PRO B 124 10.550 -9.360 -1.683 1.00 0.00 C ATOM 1246 CD PRO B 124 10.938 -8.217 -2.617 1.00 0.00 C ATOM 0 HA PRO B 124 7.764 -8.119 -2.921 1.00 0.00 H new ATOM 0 HB2 PRO B 124 8.546 -9.956 -1.078 1.00 0.00 H new ATOM 0 HB3 PRO B 124 8.868 -10.194 -2.784 1.00 0.00 H new ATOM 0 HG2 PRO B 124 10.753 -9.114 -0.641 1.00 0.00 H new ATOM 0 HG3 PRO B 124 11.104 -10.271 -1.910 1.00 0.00 H new ATOM 0 HD2 PRO B 124 11.754 -7.630 -2.195 1.00 0.00 H new ATOM 0 HD3 PRO B 124 11.284 -8.599 -3.577 1.00 0.00 H new ATOM 1254 N MET B 125 8.781 -6.416 -0.365 1.00 0.00 N ATOM 1255 CA MET B 125 8.293 -5.686 0.812 1.00 0.00 C ATOM 1256 C MET B 125 7.104 -4.837 0.370 1.00 0.00 C ATOM 1257 O MET B 125 6.029 -4.919 0.956 1.00 0.00 O ATOM 1258 CB MET B 125 9.388 -4.814 1.455 1.00 0.00 C ATOM 1259 CG MET B 125 10.383 -5.620 2.301 1.00 0.00 C ATOM 1260 SD MET B 125 10.119 -5.578 4.095 1.00 0.00 S ATOM 1261 CE MET B 125 11.193 -6.963 4.566 1.00 0.00 C ATOM 0 H MET B 125 9.712 -6.133 -0.671 1.00 0.00 H new ATOM 0 HA MET B 125 7.992 -6.399 1.580 1.00 0.00 H new ATOM 0 HB2 MET B 125 9.931 -4.287 0.671 1.00 0.00 H new ATOM 0 HB3 MET B 125 8.918 -4.056 2.082 1.00 0.00 H new ATOM 0 HG2 MET B 125 10.350 -6.659 1.973 1.00 0.00 H new ATOM 0 HG3 MET B 125 11.388 -5.252 2.093 1.00 0.00 H new ATOM 0 HE1 MET B 125 11.163 -7.095 5.648 1.00 0.00 H new ATOM 0 HE2 MET B 125 10.846 -7.874 4.079 1.00 0.00 H new ATOM 0 HE3 MET B 125 12.216 -6.752 4.255 1.00 0.00 H new ATOM 1271 N MET B 126 7.292 -3.978 -0.642 1.00 0.00 N ATOM 1272 CA MET B 126 6.199 -3.150 -1.149 1.00 0.00 C ATOM 1273 C MET B 126 5.128 -4.054 -1.758 1.00 0.00 C ATOM 1274 O MET B 126 3.957 -3.706 -1.761 1.00 0.00 O ATOM 1275 CB MET B 126 6.662 -2.123 -2.201 1.00 0.00 C ATOM 1276 CG MET B 126 7.504 -2.731 -3.318 1.00 0.00 C ATOM 1277 SD MET B 126 7.325 -2.069 -4.989 1.00 0.00 S ATOM 1278 CE MET B 126 5.851 -2.987 -5.502 1.00 0.00 C ATOM 0 H MET B 126 8.183 -3.842 -1.119 1.00 0.00 H new ATOM 0 HA MET B 126 5.800 -2.586 -0.306 1.00 0.00 H new ATOM 0 HB2 MET B 126 5.786 -1.643 -2.638 1.00 0.00 H new ATOM 0 HB3 MET B 126 7.240 -1.343 -1.705 1.00 0.00 H new ATOM 0 HG2 MET B 126 8.552 -2.634 -3.034 1.00 0.00 H new ATOM 0 HG3 MET B 126 7.282 -3.797 -3.358 1.00 0.00 H new ATOM 0 HE1 MET B 126 5.585 -2.707 -6.521 1.00 0.00 H new ATOM 0 HE2 MET B 126 6.056 -4.057 -5.461 1.00 0.00 H new ATOM 0 HE3 MET B 126 5.024 -2.750 -4.833 1.00 0.00 H new ATOM 1288 N GLU B 127 5.519 -5.169 -2.358 1.00 0.00 N ATOM 1289 CA GLU B 127 4.589 -6.078 -2.989 1.00 0.00 C ATOM 1290 C GLU B 127 3.612 -6.663 -1.986 1.00 0.00 C ATOM 1291 O GLU B 127 2.407 -6.569 -2.212 1.00 0.00 O ATOM 1292 CB GLU B 127 5.378 -7.174 -3.680 1.00 0.00 C ATOM 1293 CG GLU B 127 4.500 -7.937 -4.655 1.00 0.00 C ATOM 1294 CD GLU B 127 5.390 -8.866 -5.467 1.00 0.00 C ATOM 1295 OE1 GLU B 127 6.225 -8.360 -6.260 1.00 0.00 O ATOM 1296 OE2 GLU B 127 5.279 -10.096 -5.313 1.00 0.00 O ATOM 0 H GLU B 127 6.493 -5.464 -2.418 1.00 0.00 H new ATOM 0 HA GLU B 127 3.996 -5.531 -3.722 1.00 0.00 H new ATOM 0 HB2 GLU B 127 6.225 -6.739 -4.210 1.00 0.00 H new ATOM 0 HB3 GLU B 127 5.785 -7.860 -2.937 1.00 0.00 H new ATOM 0 HG2 GLU B 127 3.743 -8.509 -4.118 1.00 0.00 H new ATOM 0 HG3 GLU B 127 3.971 -7.246 -5.312 1.00 0.00 H new ATOM 1303 N GLN B 128 4.137 -7.212 -0.891 1.00 0.00 N ATOM 1304 CA GLN B 128 3.366 -7.833 0.159 1.00 0.00 C ATOM 1305 C GLN B 128 2.474 -6.816 0.857 1.00 0.00 C ATOM 1306 O GLN B 128 1.295 -7.086 1.083 1.00 0.00 O ATOM 1307 CB GLN B 128 4.330 -8.503 1.157 1.00 0.00 C ATOM 1308 CG GLN B 128 3.609 -9.271 2.273 1.00 0.00 C ATOM 1309 CD GLN B 128 3.462 -8.478 3.575 1.00 0.00 C ATOM 1310 OE1 GLN B 128 4.282 -8.632 4.478 1.00 0.00 O ATOM 1311 NE2 GLN B 128 2.432 -7.657 3.730 1.00 0.00 N ATOM 0 H GLN B 128 5.142 -7.232 -0.715 1.00 0.00 H new ATOM 0 HA GLN B 128 2.711 -8.590 -0.273 1.00 0.00 H new ATOM 0 HB2 GLN B 128 4.983 -9.188 0.617 1.00 0.00 H new ATOM 0 HB3 GLN B 128 4.968 -7.740 1.604 1.00 0.00 H new ATOM 0 HG2 GLN B 128 2.619 -9.560 1.921 1.00 0.00 H new ATOM 0 HG3 GLN B 128 4.155 -10.191 2.479 1.00 0.00 H new ATOM 0 HE21 GLN B 128 1.758 -7.537 2.974 1.00 0.00 H new ATOM 0 HE22 GLN B 128 2.314 -7.146 4.605 1.00 0.00 H new ATOM 1320 N GLU B 129 3.030 -5.667 1.240 1.00 0.00 N ATOM 1321 CA GLU B 129 2.273 -4.635 1.938 1.00 0.00 C ATOM 1322 C GLU B 129 1.173 -4.077 1.042 1.00 0.00 C ATOM 1323 O GLU B 129 0.054 -3.863 1.508 1.00 0.00 O ATOM 1324 CB GLU B 129 3.219 -3.569 2.489 1.00 0.00 C ATOM 1325 CG GLU B 129 4.081 -4.133 3.632 1.00 0.00 C ATOM 1326 CD GLU B 129 3.350 -4.147 4.986 1.00 0.00 C ATOM 1327 OE1 GLU B 129 2.673 -5.152 5.318 1.00 0.00 O ATOM 1328 OE2 GLU B 129 3.454 -3.147 5.741 1.00 0.00 O ATOM 0 H GLU B 129 4.008 -5.429 1.076 1.00 0.00 H new ATOM 0 HA GLU B 129 1.765 -5.069 2.799 1.00 0.00 H new ATOM 0 HB2 GLU B 129 3.863 -3.202 1.690 1.00 0.00 H new ATOM 0 HB3 GLU B 129 2.642 -2.718 2.850 1.00 0.00 H new ATOM 0 HG2 GLU B 129 4.388 -5.148 3.381 1.00 0.00 H new ATOM 0 HG3 GLU B 129 4.990 -3.538 3.722 1.00 0.00 H new ATOM 1335 N ILE B 130 1.446 -3.882 -0.250 1.00 0.00 N ATOM 1336 CA ILE B 130 0.429 -3.349 -1.133 1.00 0.00 C ATOM 1337 C ILE B 130 -0.609 -4.406 -1.456 1.00 0.00 C ATOM 1338 O ILE B 130 -1.775 -4.036 -1.373 1.00 0.00 O ATOM 1339 CB ILE B 130 1.007 -2.594 -2.346 1.00 0.00 C ATOM 1340 CG1 ILE B 130 1.488 -1.211 -1.860 1.00 0.00 C ATOM 1341 CG2 ILE B 130 -0.067 -2.337 -3.420 1.00 0.00 C ATOM 1342 CD1 ILE B 130 2.772 -1.136 -1.045 1.00 0.00 C ATOM 0 H ILE B 130 2.343 -4.082 -0.692 1.00 0.00 H new ATOM 0 HA ILE B 130 -0.107 -2.564 -0.600 1.00 0.00 H new ATOM 0 HB ILE B 130 1.808 -3.198 -2.772 1.00 0.00 H new ATOM 0 HG12 ILE B 130 1.614 -0.576 -2.737 1.00 0.00 H new ATOM 0 HG13 ILE B 130 0.689 -0.773 -1.262 1.00 0.00 H new ATOM 0 HG21 ILE B 130 0.378 -1.803 -4.259 1.00 0.00 H new ATOM 0 HG22 ILE B 130 -0.469 -3.289 -3.768 1.00 0.00 H new ATOM 0 HG23 ILE B 130 -0.871 -1.737 -2.994 1.00 0.00 H new ATOM 0 HD11 ILE B 130 2.974 -0.098 -0.780 1.00 0.00 H new ATOM 0 HD12 ILE B 130 2.661 -1.728 -0.136 1.00 0.00 H new ATOM 0 HD13 ILE B 130 3.601 -1.528 -1.635 1.00 0.00 H new ATOM 1354 N GLU B 131 -0.271 -5.658 -1.810 1.00 0.00 N ATOM 1355 CA GLU B 131 -1.333 -6.631 -2.096 1.00 0.00 C ATOM 1356 C GLU B 131 -2.266 -6.753 -0.894 1.00 0.00 C ATOM 1357 O GLU B 131 -3.480 -6.844 -1.081 1.00 0.00 O ATOM 1358 CB GLU B 131 -0.824 -7.993 -2.585 1.00 0.00 C ATOM 1359 CG GLU B 131 -0.052 -8.827 -1.554 1.00 0.00 C ATOM 1360 CD GLU B 131 0.498 -10.131 -2.138 1.00 0.00 C ATOM 1361 OE1 GLU B 131 0.425 -10.343 -3.370 1.00 0.00 O ATOM 1362 OE2 GLU B 131 0.961 -10.996 -1.358 1.00 0.00 O ATOM 0 H GLU B 131 0.683 -6.007 -1.902 1.00 0.00 H new ATOM 0 HA GLU B 131 -1.899 -6.242 -2.942 1.00 0.00 H new ATOM 0 HB2 GLU B 131 -1.678 -8.576 -2.930 1.00 0.00 H new ATOM 0 HB3 GLU B 131 -0.179 -7.830 -3.449 1.00 0.00 H new ATOM 0 HG2 GLU B 131 0.773 -8.235 -1.159 1.00 0.00 H new ATOM 0 HG3 GLU B 131 -0.709 -9.058 -0.715 1.00 0.00 H new ATOM 1369 N GLU B 132 -1.712 -6.678 0.320 1.00 0.00 N ATOM 1370 CA GLU B 132 -2.483 -6.746 1.546 1.00 0.00 C ATOM 1371 C GLU B 132 -3.477 -5.578 1.550 1.00 0.00 C ATOM 1372 O GLU B 132 -4.662 -5.780 1.806 1.00 0.00 O ATOM 1373 CB GLU B 132 -1.537 -6.732 2.759 1.00 0.00 C ATOM 1374 CG GLU B 132 -2.330 -6.904 4.053 1.00 0.00 C ATOM 1375 CD GLU B 132 -1.419 -7.075 5.267 1.00 0.00 C ATOM 1376 OE1 GLU B 132 -1.126 -8.236 5.635 1.00 0.00 O ATOM 1377 OE2 GLU B 132 -1.128 -6.072 5.958 1.00 0.00 O ATOM 0 H GLU B 132 -0.709 -6.568 0.471 1.00 0.00 H new ATOM 0 HA GLU B 132 -3.050 -7.675 1.608 1.00 0.00 H new ATOM 0 HB2 GLU B 132 -0.803 -7.532 2.665 1.00 0.00 H new ATOM 0 HB3 GLU B 132 -0.983 -5.793 2.786 1.00 0.00 H new ATOM 0 HG2 GLU B 132 -2.973 -6.036 4.202 1.00 0.00 H new ATOM 0 HG3 GLU B 132 -2.983 -7.773 3.965 1.00 0.00 H new ATOM 1384 N ILE B 133 -3.046 -4.356 1.209 1.00 0.00 N ATOM 1385 CA ILE B 133 -3.932 -3.196 1.182 1.00 0.00 C ATOM 1386 C ILE B 133 -4.964 -3.316 0.066 1.00 0.00 C ATOM 1387 O ILE B 133 -6.128 -2.954 0.273 1.00 0.00 O ATOM 1388 CB ILE B 133 -3.105 -1.897 1.095 1.00 0.00 C ATOM 1389 CG1 ILE B 133 -2.339 -1.726 2.429 1.00 0.00 C ATOM 1390 CG2 ILE B 133 -4.007 -0.662 0.921 1.00 0.00 C ATOM 1391 CD1 ILE B 133 -1.193 -0.726 2.361 1.00 0.00 C ATOM 0 H ILE B 133 -2.082 -4.150 0.947 1.00 0.00 H new ATOM 0 HA ILE B 133 -4.496 -3.158 2.114 1.00 0.00 H new ATOM 0 HB ILE B 133 -2.437 -1.972 0.237 1.00 0.00 H new ATOM 0 HG12 ILE B 133 -3.040 -1.408 3.201 1.00 0.00 H new ATOM 0 HG13 ILE B 133 -1.945 -2.695 2.737 1.00 0.00 H new ATOM 0 HG21 ILE B 133 -3.389 0.234 0.864 1.00 0.00 H new ATOM 0 HG22 ILE B 133 -4.588 -0.762 0.004 1.00 0.00 H new ATOM 0 HG23 ILE B 133 -4.683 -0.583 1.772 1.00 0.00 H new ATOM 0 HD11 ILE B 133 -0.707 -0.663 3.335 1.00 0.00 H new ATOM 0 HD12 ILE B 133 -0.469 -1.052 1.614 1.00 0.00 H new ATOM 0 HD13 ILE B 133 -1.582 0.254 2.085 1.00 0.00 H new ATOM 1403 N ARG B 134 -4.570 -3.801 -1.114 1.00 0.00 N ATOM 1404 CA ARG B 134 -5.495 -3.955 -2.227 1.00 0.00 C ATOM 1405 C ARG B 134 -6.615 -4.872 -1.768 1.00 0.00 C ATOM 1406 O ARG B 134 -7.779 -4.522 -1.938 1.00 0.00 O ATOM 1407 CB ARG B 134 -4.810 -4.496 -3.489 1.00 0.00 C ATOM 1408 CG ARG B 134 -3.567 -3.686 -3.892 1.00 0.00 C ATOM 1409 CD ARG B 134 -3.358 -3.634 -5.399 1.00 0.00 C ATOM 1410 NE ARG B 134 -4.346 -2.768 -6.043 1.00 0.00 N ATOM 1411 CZ ARG B 134 -4.746 -2.815 -7.312 1.00 0.00 C ATOM 1412 NH1 ARG B 134 -4.191 -3.636 -8.195 1.00 0.00 N ATOM 1413 NH2 ARG B 134 -5.739 -2.024 -7.685 1.00 0.00 N ATOM 0 H ARG B 134 -3.614 -4.093 -1.318 1.00 0.00 H new ATOM 0 HA ARG B 134 -5.890 -2.979 -2.508 1.00 0.00 H new ATOM 0 HB2 ARG B 134 -4.522 -5.534 -3.323 1.00 0.00 H new ATOM 0 HB3 ARG B 134 -5.523 -4.491 -4.313 1.00 0.00 H new ATOM 0 HG2 ARG B 134 -3.661 -2.670 -3.508 1.00 0.00 H new ATOM 0 HG3 ARG B 134 -2.686 -4.124 -3.423 1.00 0.00 H new ATOM 0 HD2 ARG B 134 -2.354 -3.269 -5.617 1.00 0.00 H new ATOM 0 HD3 ARG B 134 -3.428 -4.640 -5.813 1.00 0.00 H new ATOM 0 HE ARG B 134 -4.774 -2.051 -5.457 1.00 0.00 H new ATOM 0 HH11 ARG B 134 -3.434 -4.256 -7.909 1.00 0.00 H new ATOM 0 HH12 ARG B 134 -4.522 -3.646 -9.160 1.00 0.00 H new ATOM 0 HH21 ARG B 134 -6.176 -1.400 -7.007 1.00 0.00 H new ATOM 0 HH22 ARG B 134 -6.067 -2.038 -8.651 1.00 0.00 H new ATOM 1427 N GLN B 135 -6.263 -6.001 -1.150 1.00 0.00 N ATOM 1428 CA GLN B 135 -7.207 -6.983 -0.645 1.00 0.00 C ATOM 1429 C GLN B 135 -8.068 -6.401 0.474 1.00 0.00 C ATOM 1430 O GLN B 135 -9.294 -6.412 0.353 1.00 0.00 O ATOM 1431 CB GLN B 135 -6.449 -8.219 -0.144 1.00 0.00 C ATOM 1432 CG GLN B 135 -5.924 -9.063 -1.310 1.00 0.00 C ATOM 1433 CD GLN B 135 -7.062 -9.759 -2.050 1.00 0.00 C ATOM 1434 OE1 GLN B 135 -7.766 -10.588 -1.481 1.00 0.00 O ATOM 1435 NE2 GLN B 135 -7.292 -9.422 -3.309 1.00 0.00 N ATOM 0 H GLN B 135 -5.290 -6.258 -0.986 1.00 0.00 H new ATOM 0 HA GLN B 135 -7.871 -7.271 -1.460 1.00 0.00 H new ATOM 0 HB2 GLN B 135 -5.616 -7.906 0.485 1.00 0.00 H new ATOM 0 HB3 GLN B 135 -7.108 -8.825 0.478 1.00 0.00 H new ATOM 0 HG2 GLN B 135 -5.373 -8.427 -2.003 1.00 0.00 H new ATOM 0 HG3 GLN B 135 -5.222 -9.808 -0.935 1.00 0.00 H new ATOM 0 HE21 GLN B 135 -6.698 -8.731 -3.769 1.00 0.00 H new ATOM 0 HE22 GLN B 135 -8.063 -9.853 -3.820 1.00 0.00 H new ATOM 1444 N LYS B 136 -7.458 -5.802 1.505 1.00 0.00 N ATOM 1445 CA LYS B 136 -8.174 -5.241 2.650 1.00 0.00 C ATOM 1446 C LYS B 136 -9.252 -4.273 2.177 1.00 0.00 C ATOM 1447 O LYS B 136 -10.400 -4.367 2.627 1.00 0.00 O ATOM 1448 CB LYS B 136 -7.181 -4.676 3.700 1.00 0.00 C ATOM 1449 CG LYS B 136 -6.944 -3.152 3.747 1.00 0.00 C ATOM 1450 CD LYS B 136 -5.742 -2.717 4.613 1.00 0.00 C ATOM 1451 CE LYS B 136 -5.554 -3.533 5.893 1.00 0.00 C ATOM 1452 NZ LYS B 136 -4.380 -3.116 6.682 1.00 0.00 N ATOM 0 H LYS B 136 -6.446 -5.694 1.565 1.00 0.00 H new ATOM 0 HA LYS B 136 -8.712 -6.026 3.181 1.00 0.00 H new ATOM 0 HB2 LYS B 136 -7.528 -4.988 4.685 1.00 0.00 H new ATOM 0 HB3 LYS B 136 -6.216 -5.156 3.535 1.00 0.00 H new ATOM 0 HG2 LYS B 136 -6.793 -2.789 2.730 1.00 0.00 H new ATOM 0 HG3 LYS B 136 -7.844 -2.669 4.128 1.00 0.00 H new ATOM 0 HD2 LYS B 136 -4.834 -2.789 4.014 1.00 0.00 H new ATOM 0 HD3 LYS B 136 -5.864 -1.668 4.881 1.00 0.00 H new ATOM 0 HE2 LYS B 136 -6.449 -3.441 6.509 1.00 0.00 H new ATOM 0 HE3 LYS B 136 -5.453 -4.587 5.633 1.00 0.00 H new ATOM 0 HZ1 LYS B 136 -4.308 -3.706 7.535 1.00 0.00 H new ATOM 0 HZ2 LYS B 136 -3.519 -3.228 6.109 1.00 0.00 H new ATOM 0 HZ3 LYS B 136 -4.484 -2.119 6.959 1.00 0.00 H new ATOM 1466 N TYR B 137 -8.919 -3.329 1.304 1.00 0.00 N ATOM 1467 CA TYR B 137 -9.895 -2.383 0.793 1.00 0.00 C ATOM 1468 C TYR B 137 -10.832 -3.012 -0.235 1.00 0.00 C ATOM 1469 O TYR B 137 -12.014 -2.674 -0.219 1.00 0.00 O ATOM 1470 CB TYR B 137 -9.205 -1.118 0.287 1.00 0.00 C ATOM 1471 CG TYR B 137 -8.749 -0.228 1.428 1.00 0.00 C ATOM 1472 CD1 TYR B 137 -9.674 0.288 2.357 1.00 0.00 C ATOM 1473 CD2 TYR B 137 -7.386 0.063 1.582 1.00 0.00 C ATOM 1474 CE1 TYR B 137 -9.233 1.080 3.428 1.00 0.00 C ATOM 1475 CE2 TYR B 137 -6.934 0.859 2.648 1.00 0.00 C ATOM 1476 CZ TYR B 137 -7.860 1.362 3.585 1.00 0.00 C ATOM 1477 OH TYR B 137 -7.460 2.095 4.653 1.00 0.00 O ATOM 0 H TYR B 137 -7.976 -3.201 0.936 1.00 0.00 H new ATOM 0 HA TYR B 137 -10.541 -2.085 1.619 1.00 0.00 H new ATOM 0 HB2 TYR B 137 -8.346 -1.393 -0.325 1.00 0.00 H new ATOM 0 HB3 TYR B 137 -9.889 -0.563 -0.355 1.00 0.00 H new ATOM 0 HD1 TYR B 137 -10.726 0.073 2.244 1.00 0.00 H new ATOM 0 HD2 TYR B 137 -6.674 -0.330 0.872 1.00 0.00 H new ATOM 0 HE1 TYR B 137 -9.948 1.475 4.135 1.00 0.00 H new ATOM 0 HE2 TYR B 137 -5.883 1.084 2.749 1.00 0.00 H new ATOM 0 HH TYR B 137 -6.490 2.009 4.764 1.00 0.00 H new ATOM 1487 N GLN B 138 -10.373 -3.924 -1.103 1.00 0.00 N ATOM 1488 CA GLN B 138 -11.225 -4.555 -2.112 1.00 0.00 C ATOM 1489 C GLN B 138 -12.388 -5.253 -1.429 1.00 0.00 C ATOM 1490 O GLN B 138 -13.531 -4.977 -1.785 1.00 0.00 O ATOM 1491 CB GLN B 138 -10.445 -5.523 -3.018 1.00 0.00 C ATOM 1492 CG GLN B 138 -11.359 -6.242 -4.031 1.00 0.00 C ATOM 1493 CD GLN B 138 -11.935 -7.579 -3.552 1.00 0.00 C ATOM 1494 OE1 GLN B 138 -11.272 -8.384 -2.908 1.00 0.00 O ATOM 1495 NE2 GLN B 138 -13.195 -7.848 -3.849 1.00 0.00 N ATOM 0 H GLN B 138 -9.404 -4.242 -1.123 1.00 0.00 H new ATOM 0 HA GLN B 138 -11.610 -3.773 -2.766 1.00 0.00 H new ATOM 0 HB2 GLN B 138 -9.673 -4.972 -3.556 1.00 0.00 H new ATOM 0 HB3 GLN B 138 -9.936 -6.264 -2.401 1.00 0.00 H new ATOM 0 HG2 GLN B 138 -12.185 -5.579 -4.286 1.00 0.00 H new ATOM 0 HG3 GLN B 138 -10.795 -6.415 -4.947 1.00 0.00 H new ATOM 0 HE21 GLN B 138 -13.747 -7.178 -4.385 1.00 0.00 H new ATOM 0 HE22 GLN B 138 -13.615 -8.725 -3.542 1.00 0.00 H new ATOM 1504 N SER B 139 -12.121 -6.093 -0.428 1.00 0.00 N ATOM 1505 CA SER B 139 -13.152 -6.807 0.312 1.00 0.00 C ATOM 1506 C SER B 139 -14.187 -5.827 0.865 1.00 0.00 C ATOM 1507 O SER B 139 -15.366 -6.162 0.909 1.00 0.00 O ATOM 1508 CB SER B 139 -12.488 -7.640 1.412 1.00 0.00 C ATOM 1509 OG SER B 139 -11.467 -8.434 0.837 1.00 0.00 O ATOM 0 H SER B 139 -11.174 -6.296 -0.109 1.00 0.00 H new ATOM 0 HA SER B 139 -13.690 -7.486 -0.350 1.00 0.00 H new ATOM 0 HB2 SER B 139 -12.070 -6.987 2.178 1.00 0.00 H new ATOM 0 HB3 SER B 139 -13.227 -8.274 1.902 1.00 0.00 H new ATOM 0 HG SER B 139 -10.640 -7.911 0.778 1.00 0.00 H new ATOM 1515 N LYS B 140 -13.764 -4.636 1.308 1.00 0.00 N ATOM 1516 CA LYS B 140 -14.659 -3.599 1.827 1.00 0.00 C ATOM 1517 C LYS B 140 -15.406 -2.875 0.706 1.00 0.00 C ATOM 1518 O LYS B 140 -16.572 -2.530 0.880 1.00 0.00 O ATOM 1519 CB LYS B 140 -13.931 -2.657 2.802 1.00 0.00 C ATOM 1520 CG LYS B 140 -13.563 -3.459 4.062 1.00 0.00 C ATOM 1521 CD LYS B 140 -13.086 -2.620 5.256 1.00 0.00 C ATOM 1522 CE LYS B 140 -11.586 -2.313 5.259 1.00 0.00 C ATOM 1523 NZ LYS B 140 -10.750 -3.529 5.303 1.00 0.00 N ATOM 0 H LYS B 140 -12.781 -4.365 1.315 1.00 0.00 H new ATOM 0 HA LYS B 140 -15.433 -4.090 2.417 1.00 0.00 H new ATOM 0 HB2 LYS B 140 -13.034 -2.248 2.337 1.00 0.00 H new ATOM 0 HB3 LYS B 140 -14.569 -1.812 3.062 1.00 0.00 H new ATOM 0 HG2 LYS B 140 -14.433 -4.039 4.371 1.00 0.00 H new ATOM 0 HG3 LYS B 140 -12.780 -4.172 3.804 1.00 0.00 H new ATOM 0 HD2 LYS B 140 -13.636 -1.679 5.265 1.00 0.00 H new ATOM 0 HD3 LYS B 140 -13.338 -3.146 6.177 1.00 0.00 H new ATOM 0 HE2 LYS B 140 -11.336 -1.739 4.367 1.00 0.00 H new ATOM 0 HE3 LYS B 140 -11.351 -1.685 6.118 1.00 0.00 H new ATOM 0 HZ1 LYS B 140 -9.844 -3.311 5.764 1.00 0.00 H new ATOM 0 HZ2 LYS B 140 -11.243 -4.270 5.841 1.00 0.00 H new ATOM 0 HZ3 LYS B 140 -10.573 -3.864 4.334 1.00 0.00 H new ATOM 1537 N ARG B 141 -14.779 -2.618 -0.449 1.00 0.00 N ATOM 1538 CA ARG B 141 -15.434 -1.944 -1.576 1.00 0.00 C ATOM 1539 C ARG B 141 -16.450 -2.877 -2.224 1.00 0.00 C ATOM 1540 O ARG B 141 -17.492 -2.415 -2.672 1.00 0.00 O ATOM 1541 CB ARG B 141 -14.410 -1.440 -2.618 1.00 0.00 C ATOM 1542 CG ARG B 141 -15.066 -0.436 -3.594 1.00 0.00 C ATOM 1543 CD ARG B 141 -14.077 0.369 -4.452 1.00 0.00 C ATOM 1544 NE ARG B 141 -13.326 -0.473 -5.395 1.00 0.00 N ATOM 1545 CZ ARG B 141 -12.440 -0.056 -6.310 1.00 0.00 C ATOM 1546 NH1 ARG B 141 -12.123 1.227 -6.482 1.00 0.00 N ATOM 1547 NH2 ARG B 141 -11.843 -0.983 -7.047 1.00 0.00 N ATOM 0 H ARG B 141 -13.807 -2.871 -0.628 1.00 0.00 H new ATOM 0 HA ARG B 141 -15.954 -1.068 -1.187 1.00 0.00 H new ATOM 0 HB2 ARG B 141 -13.572 -0.964 -2.109 1.00 0.00 H new ATOM 0 HB3 ARG B 141 -14.006 -2.285 -3.176 1.00 0.00 H new ATOM 0 HG2 ARG B 141 -15.739 -0.981 -4.256 1.00 0.00 H new ATOM 0 HG3 ARG B 141 -15.678 0.260 -3.020 1.00 0.00 H new ATOM 0 HD2 ARG B 141 -14.622 1.132 -5.008 1.00 0.00 H new ATOM 0 HD3 ARG B 141 -13.376 0.890 -3.799 1.00 0.00 H new ATOM 0 HE ARG B 141 -13.497 -1.477 -5.348 1.00 0.00 H new ATOM 0 HH11 ARG B 141 -12.562 1.943 -5.903 1.00 0.00 H new ATOM 0 HH12 ARG B 141 -11.442 1.493 -7.193 1.00 0.00 H new ATOM 0 HH21 ARG B 141 -12.065 -1.968 -6.905 1.00 0.00 H new ATOM 0 HH22 ARG B 141 -11.162 -0.711 -7.755 1.00 0.00 H new ATOM 1561 N GLN B 142 -16.168 -4.175 -2.228 1.00 0.00 N ATOM 1562 CA GLN B 142 -16.987 -5.221 -2.806 1.00 0.00 C ATOM 1563 C GLN B 142 -18.460 -5.162 -2.388 1.00 0.00 C ATOM 1564 O GLN B 142 -19.286 -5.027 -3.284 1.00 0.00 O ATOM 1565 CB GLN B 142 -16.338 -6.598 -2.596 1.00 0.00 C ATOM 1566 CG GLN B 142 -17.010 -7.673 -3.457 1.00 0.00 C ATOM 1567 CD GLN B 142 -16.812 -7.383 -4.938 1.00 0.00 C ATOM 1568 OE1 GLN B 142 -15.746 -7.662 -5.490 1.00 0.00 O ATOM 1569 NE2 GLN B 142 -17.767 -6.724 -5.576 1.00 0.00 N ATOM 0 H GLN B 142 -15.315 -4.540 -1.804 1.00 0.00 H new ATOM 0 HA GLN B 142 -17.022 -5.041 -3.880 1.00 0.00 H new ATOM 0 HB2 GLN B 142 -15.278 -6.543 -2.843 1.00 0.00 H new ATOM 0 HB3 GLN B 142 -16.407 -6.877 -1.545 1.00 0.00 H new ATOM 0 HG2 GLN B 142 -16.594 -8.651 -3.215 1.00 0.00 H new ATOM 0 HG3 GLN B 142 -18.075 -7.714 -3.229 1.00 0.00 H new ATOM 0 HE21 GLN B 142 -18.641 -6.504 -5.099 1.00 0.00 H new ATOM 0 HE22 GLN B 142 -17.628 -6.436 -6.545 1.00 0.00 H new ATOM 1578 N PRO B 143 -18.838 -5.230 -1.099 1.00 0.00 N ATOM 1579 CA PRO B 143 -20.234 -5.160 -0.713 1.00 0.00 C ATOM 1580 C PRO B 143 -20.824 -3.799 -1.092 1.00 0.00 C ATOM 1581 O PRO B 143 -21.991 -3.718 -1.455 1.00 0.00 O ATOM 1582 CB PRO B 143 -20.279 -5.415 0.798 1.00 0.00 C ATOM 1583 CG PRO B 143 -18.886 -5.001 1.261 1.00 0.00 C ATOM 1584 CD PRO B 143 -18.020 -5.400 0.076 1.00 0.00 C ATOM 0 HA PRO B 143 -20.838 -5.903 -1.233 1.00 0.00 H new ATOM 0 HB2 PRO B 143 -21.057 -4.825 1.283 1.00 0.00 H new ATOM 0 HB3 PRO B 143 -20.484 -6.461 1.024 1.00 0.00 H new ATOM 0 HG2 PRO B 143 -18.827 -3.932 1.467 1.00 0.00 H new ATOM 0 HG3 PRO B 143 -18.590 -5.518 2.174 1.00 0.00 H new ATOM 0 HD2 PRO B 143 -17.126 -4.778 0.021 1.00 0.00 H new ATOM 0 HD3 PRO B 143 -17.684 -6.433 0.170 1.00 0.00 H new ATOM 1592 N ILE B 144 -20.042 -2.720 -1.029 1.00 0.00 N ATOM 1593 CA ILE B 144 -20.534 -1.400 -1.378 1.00 0.00 C ATOM 1594 C ILE B 144 -20.959 -1.379 -2.857 1.00 0.00 C ATOM 1595 O ILE B 144 -22.078 -0.975 -3.165 1.00 0.00 O ATOM 1596 CB ILE B 144 -19.495 -0.311 -1.027 1.00 0.00 C ATOM 1597 CG1 ILE B 144 -19.032 -0.325 0.449 1.00 0.00 C ATOM 1598 CG2 ILE B 144 -20.176 1.036 -1.273 1.00 0.00 C ATOM 1599 CD1 ILE B 144 -17.783 0.530 0.710 1.00 0.00 C ATOM 0 H ILE B 144 -19.065 -2.742 -0.738 1.00 0.00 H new ATOM 0 HA ILE B 144 -21.419 -1.170 -0.784 1.00 0.00 H new ATOM 0 HB ILE B 144 -18.611 -0.492 -1.639 1.00 0.00 H new ATOM 0 HG12 ILE B 144 -19.846 0.033 1.080 1.00 0.00 H new ATOM 0 HG13 ILE B 144 -18.827 -1.353 0.747 1.00 0.00 H new ATOM 0 HG21 ILE B 144 -19.482 1.843 -1.039 1.00 0.00 H new ATOM 0 HG22 ILE B 144 -20.475 1.107 -2.319 1.00 0.00 H new ATOM 0 HG23 ILE B 144 -21.057 1.120 -0.637 1.00 0.00 H new ATOM 0 HD11 ILE B 144 -17.517 0.472 1.765 1.00 0.00 H new ATOM 0 HD12 ILE B 144 -16.955 0.159 0.106 1.00 0.00 H new ATOM 0 HD13 ILE B 144 -17.990 1.567 0.444 1.00 0.00 H new ATOM 1611 N LEU B 145 -20.082 -1.805 -3.769 1.00 0.00 N ATOM 1612 CA LEU B 145 -20.371 -1.817 -5.203 1.00 0.00 C ATOM 1613 C LEU B 145 -21.493 -2.797 -5.535 1.00 0.00 C ATOM 1614 O LEU B 145 -22.348 -2.512 -6.367 1.00 0.00 O ATOM 1615 CB LEU B 145 -19.087 -2.021 -6.019 1.00 0.00 C ATOM 1616 CG LEU B 145 -18.586 -3.455 -6.228 1.00 0.00 C ATOM 1617 CD1 LEU B 145 -19.074 -4.046 -7.550 1.00 0.00 C ATOM 1618 CD2 LEU B 145 -17.056 -3.457 -6.190 1.00 0.00 C ATOM 0 H LEU B 145 -19.152 -2.151 -3.533 1.00 0.00 H new ATOM 0 HA LEU B 145 -20.752 -0.839 -5.498 1.00 0.00 H new ATOM 0 HB2 LEU B 145 -19.242 -1.575 -7.001 1.00 0.00 H new ATOM 0 HB3 LEU B 145 -18.290 -1.456 -5.534 1.00 0.00 H new ATOM 0 HG LEU B 145 -18.988 -4.077 -5.428 1.00 0.00 H new ATOM 0 HD11 LEU B 145 -18.695 -5.063 -7.656 1.00 0.00 H new ATOM 0 HD12 LEU B 145 -20.164 -4.062 -7.561 1.00 0.00 H new ATOM 0 HD13 LEU B 145 -18.712 -3.436 -8.377 1.00 0.00 H new ATOM 0 HD21 LEU B 145 -16.690 -4.473 -6.338 1.00 0.00 H new ATOM 0 HD22 LEU B 145 -16.672 -2.814 -6.982 1.00 0.00 H new ATOM 0 HD23 LEU B 145 -16.716 -3.086 -5.223 1.00 0.00 H new ATOM 1630 N ASP B 146 -21.517 -3.932 -4.845 1.00 0.00 N ATOM 1631 CA ASP B 146 -22.531 -4.966 -5.025 1.00 0.00 C ATOM 1632 C ASP B 146 -23.909 -4.419 -4.643 1.00 0.00 C ATOM 1633 O ASP B 146 -24.882 -4.640 -5.354 1.00 0.00 O ATOM 1634 CB ASP B 146 -22.160 -6.159 -4.143 1.00 0.00 C ATOM 1635 CG ASP B 146 -23.328 -7.102 -3.890 1.00 0.00 C ATOM 1636 OD1 ASP B 146 -23.504 -8.055 -4.674 1.00 0.00 O ATOM 1637 OD2 ASP B 146 -23.977 -6.953 -2.832 1.00 0.00 O ATOM 0 H ASP B 146 -20.823 -4.163 -4.134 1.00 0.00 H new ATOM 0 HA ASP B 146 -22.572 -5.280 -6.068 1.00 0.00 H new ATOM 0 HB2 ASP B 146 -21.349 -6.714 -4.615 1.00 0.00 H new ATOM 0 HB3 ASP B 146 -21.783 -5.793 -3.188 1.00 0.00 H new ATOM 1642 N ALA B 147 -23.978 -3.656 -3.547 1.00 0.00 N ATOM 1643 CA ALA B 147 -25.210 -3.070 -3.047 1.00 0.00 C ATOM 1644 C ALA B 147 -25.820 -2.082 -4.045 1.00 0.00 C ATOM 1645 O ALA B 147 -27.025 -2.126 -4.263 1.00 0.00 O ATOM 1646 CB ALA B 147 -24.938 -2.383 -1.713 1.00 0.00 C ATOM 0 H ALA B 147 -23.162 -3.429 -2.979 1.00 0.00 H new ATOM 0 HA ALA B 147 -25.936 -3.871 -2.907 1.00 0.00 H new ATOM 0 HB1 ALA B 147 -25.861 -1.942 -1.336 1.00 0.00 H new ATOM 0 HB2 ALA B 147 -24.566 -3.115 -0.996 1.00 0.00 H new ATOM 0 HB3 ALA B 147 -24.193 -1.600 -1.852 1.00 0.00 H new ATOM 1652 N ILE B 148 -25.039 -1.162 -4.622 1.00 0.00 N ATOM 1653 CA ILE B 148 -25.573 -0.194 -5.591 1.00 0.00 C ATOM 1654 C ILE B 148 -26.025 -0.885 -6.868 1.00 0.00 C ATOM 1655 O ILE B 148 -26.957 -0.420 -7.520 1.00 0.00 O ATOM 1656 CB ILE B 148 -24.582 0.943 -5.884 1.00 0.00 C ATOM 1657 CG1 ILE B 148 -25.181 2.021 -6.798 1.00 0.00 C ATOM 1658 CG2 ILE B 148 -23.225 0.445 -6.388 1.00 0.00 C ATOM 1659 CD1 ILE B 148 -24.505 3.383 -6.602 1.00 0.00 C ATOM 0 H ILE B 148 -24.040 -1.066 -4.437 1.00 0.00 H new ATOM 0 HA ILE B 148 -26.449 0.265 -5.133 1.00 0.00 H new ATOM 0 HB ILE B 148 -24.387 1.418 -4.923 1.00 0.00 H new ATOM 0 HG12 ILE B 148 -25.078 1.712 -7.838 1.00 0.00 H new ATOM 0 HG13 ILE B 148 -26.248 2.114 -6.597 1.00 0.00 H new ATOM 0 HG21 ILE B 148 -22.572 1.297 -6.576 1.00 0.00 H new ATOM 0 HG22 ILE B 148 -22.772 -0.201 -5.636 1.00 0.00 H new ATOM 0 HG23 ILE B 148 -23.364 -0.117 -7.312 1.00 0.00 H new ATOM 0 HD11 ILE B 148 -24.961 4.115 -7.269 1.00 0.00 H new ATOM 0 HD12 ILE B 148 -24.630 3.706 -5.569 1.00 0.00 H new ATOM 0 HD13 ILE B 148 -23.442 3.298 -6.829 1.00 0.00 H new ATOM 1671 N GLU B 149 -25.329 -1.955 -7.253 1.00 0.00 N ATOM 1672 CA GLU B 149 -25.653 -2.722 -8.447 1.00 0.00 C ATOM 1673 C GLU B 149 -26.995 -3.454 -8.294 1.00 0.00 C ATOM 1674 O GLU B 149 -27.518 -3.972 -9.285 1.00 0.00 O ATOM 1675 CB GLU B 149 -24.513 -3.688 -8.795 1.00 0.00 C ATOM 1676 CG GLU B 149 -23.377 -2.935 -9.494 1.00 0.00 C ATOM 1677 CD GLU B 149 -22.171 -3.811 -9.818 1.00 0.00 C ATOM 1678 OE1 GLU B 149 -22.269 -5.066 -9.800 1.00 0.00 O ATOM 1679 OE2 GLU B 149 -21.112 -3.218 -10.141 1.00 0.00 O ATOM 0 H GLU B 149 -24.522 -2.312 -6.741 1.00 0.00 H new ATOM 0 HA GLU B 149 -25.764 -2.027 -9.279 1.00 0.00 H new ATOM 0 HB2 GLU B 149 -24.140 -4.164 -7.888 1.00 0.00 H new ATOM 0 HB3 GLU B 149 -24.885 -4.483 -9.442 1.00 0.00 H new ATOM 0 HG2 GLU B 149 -23.757 -2.498 -10.418 1.00 0.00 H new ATOM 0 HG3 GLU B 149 -23.055 -2.109 -8.859 1.00 0.00 H new ATOM 1686 N ALA B 150 -27.515 -3.526 -7.063 1.00 0.00 N ATOM 1687 CA ALA B 150 -28.776 -4.140 -6.683 1.00 0.00 C ATOM 1688 C ALA B 150 -29.886 -3.072 -6.558 1.00 0.00 C ATOM 1689 O ALA B 150 -30.929 -3.335 -5.957 1.00 0.00 O ATOM 1690 CB ALA B 150 -28.582 -4.938 -5.386 1.00 0.00 C ATOM 0 H ALA B 150 -27.028 -3.129 -6.260 1.00 0.00 H new ATOM 0 HA ALA B 150 -29.098 -4.834 -7.459 1.00 0.00 H new ATOM 0 HB1 ALA B 150 -29.526 -5.400 -5.098 1.00 0.00 H new ATOM 0 HB2 ALA B 150 -27.832 -5.713 -5.544 1.00 0.00 H new ATOM 0 HB3 ALA B 150 -28.249 -4.268 -4.593 1.00 0.00 H new ATOM 1696 N LYS B 151 -29.644 -1.842 -7.033 1.00 0.00 N ATOM 1697 CA LYS B 151 -30.572 -0.713 -7.030 1.00 0.00 C ATOM 1698 C LYS B 151 -30.711 -0.233 -8.477 1.00 0.00 C ATOM 1699 O LYS B 151 -31.227 0.885 -8.690 1.00 0.00 O ATOM 1700 CB LYS B 151 -30.080 0.431 -6.117 1.00 0.00 C ATOM 1701 CG LYS B 151 -29.681 0.033 -4.691 1.00 0.00 C ATOM 1702 CD LYS B 151 -29.260 1.228 -3.827 1.00 0.00 C ATOM 1703 CE LYS B 151 -30.477 1.841 -3.130 1.00 0.00 C ATOM 1704 NZ LYS B 151 -30.863 1.077 -1.921 1.00 0.00 N ATOM 0 H LYS B 151 -28.746 -1.600 -7.451 1.00 0.00 H new ATOM 0 HA LYS B 151 -31.537 -1.028 -6.632 1.00 0.00 H new ATOM 0 HB2 LYS B 151 -29.222 0.905 -6.593 1.00 0.00 H new ATOM 0 HB3 LYS B 151 -30.866 1.183 -6.056 1.00 0.00 H new ATOM 0 HG2 LYS B 151 -30.519 -0.475 -4.214 1.00 0.00 H new ATOM 0 HG3 LYS B 151 -28.859 -0.682 -4.736 1.00 0.00 H new ATOM 0 HD2 LYS B 151 -28.531 0.907 -3.083 1.00 0.00 H new ATOM 0 HD3 LYS B 151 -28.772 1.979 -4.448 1.00 0.00 H new ATOM 0 HE2 LYS B 151 -30.256 2.872 -2.853 1.00 0.00 H new ATOM 0 HE3 LYS B 151 -31.317 1.871 -3.824 1.00 0.00 H new ATOM 0 HZ1 LYS B 151 -31.895 1.118 -1.799 1.00 0.00 H new ATOM 0 HZ2 LYS B 151 -30.566 0.086 -2.027 1.00 0.00 H new ATOM 0 HZ3 LYS B 151 -30.400 1.490 -1.087 1.00 0.00 H new TER 1718 LYS B 151